Search    ENTER KEYWORD
MSDS Material Safety Data Sheet
CAS

331-39-5

File Name: 331-39-5.asp

                              SIGMA-ALDRICH

Material Safety Data Sheet

Date Printed: 20/FEB/2005
Date Updated: 12/MAR/2004
Version 1.1
According to 91/155/EEC

Classified as Hazardous according to the criteria of EU Annex 1 and
NOHSC.

1 - Product and Company Information

Product Name CAFFEIC ACID
Product Number C0625

Company Sigma-Aldrich Pty, Ltd
Unit 2, 14 Anella Avenue
Castle Hill NSW 1765
Australia
Technical Phone # +61 2 9841 0555
Fax +61 2 9841 0500
Emergency Phone # +61 2 9841 0566

2 - Composition/Information on Ingredients

Product Name CAS # EC no Annex I
Index Number
3,4-DIHYDROXYCINNAMIC ACID, 331-39-5 206-361-2 None
97%,PREDOMINANTLY TRANS

Formula C9H8O4
Molecular Weight 180.16 AMU
Synonyms Caffeic acid *
4-(2'-Carboxyvinyl)-1,2-dihydroxybenzene *
3,4-Dihydroxybenzeneacrylic acid *
3,4-Dihydroxycinnamic acid *
3-(3,4-Dihydroxyphenyl)-2-propenoic acid *
2-Propenoic acid, 3-(3,4-dihydroxyphenyl)- (9CI)

3 - Hazards Identification

SPECIAL INDICATION OF HAZARDS TO HUMANS AND THE ENVIRONMENT
Limited evidence of a carcinogenic effect.


4 - First Aid Measures

AFTER INHALATION
If inhaled, remove to fresh air. If not breathing give
artificial respiration. If breathing is difficult, give oxygen.

AFTER INGESTION
If swallowed, wash out mouth with water provided person is
conscious. Call a physician.

5 - Fire Fighting Measures

EXTINGUISHING MEDIA
Suitable: Water spray. Carbon dioxide, dry chemical powder, or
appropriate foam.
SPECIAL RISKS
Specific Hazard(s): Emits toxic fumes under fire conditions.

SPECIAL PROTECTIVE EQUIPMENT FOR FIREFIGHTERS
Wear self-contained breathing apparatus and protective clothing
to prevent contact with skin and eyes.

6 - Accidental Release Measures

PERSONAL PRECAUTION PROCEDURES TO BE FOLLOWED IN CASE OF LEAK OR SPILL
Evacuate area.

PROCEDURE(S) OF PERSONAL PRECAUTION(S)
Wear self-contained breathing apparatus, rubber boots, and heavy
rubber gloves. Wear disposable coveralls and discard them after
use.

METHODS FOR CLEANING UP
Sweep up, place in a bag and hold for waste disposal. Avoid
raising dust. Ventilate area and wash spill site after material
pickup is complete.

7 - Handling and Storage

HANDLING
Directions for Safe Handling: Do not breathe dust. Do not get in
eyes, on skin, on clothing. Avoid prolonged or repeated exposure.

STORAGE
Conditions of Storage: Keep tightly closed. Store in a cool dry
place.

8 - Exposure Controls / Personal Protection

ENGINEERING CONTROLS
Safety shower and eye bath. Use only in a chemical fume hood.

GENERAL HYGIENE MEASURES
Wash contaminated clothing before reuse. Wash thoroughly after
handling.

PERSONAL PROTECTIVE EQUIPMENT
Special Protective Measures: Wear appropriate government approved
respirator, chemical-resistant gloves, safety goggles, other
protective clothing.

9 - Physical and Chemical Properties

Appearance Color: Light yellow
Form: Powder

Property Value At Temperature or Pressure

pH N/A
BP/BP Range N/A
MP/MP Range 218 掳C
Flash Point N/A
Flammability N/A
Autoignition Temp N/A
Oxidizing Properties N/A
Explosive Properties N/A


SIGMA - C0625 www.sigma-aldrich.com Page 2
Explosion Limits N/A
Vapor Pressure N/A
SG/Density N/A
Partition Coefficient N/A
Viscosity N/A
Vapor Density N/A
Saturated Vapor Conc. N/A
Evaporation Rate N/A
Bulk Density N/A
Decomposition Temp. N/A
Solvent Content N/A
Water Content N/A
Surface Tension N/A
Conductivity N/A
Miscellaneous Data N/A
Solubility N/A

10 - Stability and Reactivity

STABILITY
Stable: Stable.
Materials to Avoid: Strong oxidizing agents, Strong bases.

HAZARDOUS DECOMPOSITION PRODUCTS
Hazardous Decomposition Products: Carbon monoxide, Carbon dioxide.

HAZARDOUS POLYMERIZATION
Hazardous Polymerization: Will not occur

11 - Toxicological Information

RTECS NUMBER: GD8950000

ACUTE TOXICITY

LD50
Intraperitoneal
Mouse
>721 MG/KG

SIGNS AND SYMPTOMS OF EXPOSURE
To the best of our knowledge, the chemical, physical, and
toxicological properties have not been thoroughly investigated.

ROUTE OF EXPOSURE
Inhalation: Material is irritating to mucous membranes and upper
respiratory tract.
Multiple Routes: May be harmful by inhalation, ingestion, or
skin absorption. Causes eye and skin irritation.

TARGET ORGAN INFORMATION
G.I. System. Kidneys.

CHRONIC EXPOSURE - CARCINOGEN
Result: This product is or contains a component that has been
reported to be possibly carcinogenic based on its IARC, ACGIH,
NTP, or EPA classification.

Rat
Route of Application: Oral
Exposure Time: 2Y
Result: Tumorigenic:Carcinogenic by RTECS criteria.


SIGMA - C0625 www.sigma-aldrich.com Page 3
Gastrointestinal:Tumors. Kidney, Ureter, Bladder:Kidney tumors.

Mouse
Route of Application: Oral
Exposure Time: 96W
Result: Tumorigenic:Neoplastic by RTECS criteria. Kidney,
Ureter, Bladder:Kidney tumors.

IARC CARCINOGEN LIST

Rating: Group 2B

CHRONIC EXPOSURE - MUTAGEN

Mouse
307 MG/L
Cell Type: lymphocyte
Mutation in mammalian somatic cells.

Hamster
200 MG/L
Cell Type: ovary
Cytogenetic analysis

CHRONIC EXPOSURE - TERATOGEN
Result: Possible risk of congenital malformation in the fetus.

Species: Rat
Dose: 480 MG/KG
Route of Application: Intraperitoneal
Exposure Time: (5-12D PREG)
Result: Effects on Embryo or Fetus: Fetotoxicity (except death,
e.g., stunted fetus). Specific Developmental Abnormalities:
Musculoskeletal system.

12 - Ecological Information

No data available.

13 - Disposal Considerations

SUBSTANCE DISPOSAL
Dissolve or mix the material with a combustible solvent and burn
in a chemical incinerator equipped with an afterburner and
scrubber. Observe all federal, state, and local environmental
regulations.

14 - Transport Information

RID/ADR
Non-hazardous for road transport.

IMDG
Non-hazardous for sea transport.

IATA
Non-hazardous for air transport.

15 - Regulatory Information

CLASSIFICATION AND LABELING ACCORDING TO EU DIRECTIVES
INDICATION OF DANGER: Xn


SIGMA - C0625 www.sigma-aldrich.com Page 4
Harmful.
R-PHRASES: 40
Limited evidence of a carcinogenic effect.
S-PHRASES: 36/37/39
Wear suitable protective clothing, gloves, and eye/face
protection.

16 - Other Information

WARRANTY
The above information is believed to be correct but does not
purport to be all inclusive and shall be used only as a guide. The
information in this document is based on the present state of our
knowledge and is applicable to the product with regard to
appropriate safety precautions. It does not represent any
guarantee of the properties of the product. Sigma-Aldrich Inc.,
shall not be held liable for any damage resulting from handling or
from contact with the above product. See reverse side of invoice
or packing slip for additional terms and conditions of sale.
Copyright 2005 Sigma-Aldrich Co. License granted to make unlimited
paper copies for internal use only.

DISCLAIMER
For R&D use only. Not for drug, household or other uses.




SIGMA - C0625 www.sigma-aldrich.com Page 5

ALL Chemical Analysis PAGES IN THIS GROUP
NAMECAS
344-04-7.asp 344-04-7
115-39-9.asp 115-39-9
2800-80-8.asp 2800-80-8
76-59-5.asp 76-59-5
158113-12-3.asp 158113-12-3 7440-50-8 7440-31-5
357-57-3.asp 357-57-3
10034-93-2.asp 10034-93-2
7732-18-5.asp 7732-18-5 497-19-8 144-55-8
7732-18-5.asp 7732-18-5 877-24-7 99-76-3 915-67-3
7732-18-5.asp 7732-18-5 7778-77-0 7758-11-4
Buffer_pH_10.5_for_saturated_phenol.asp N/A
28395-03-1.asp 28395-03-1
31677-93-7.asp 31677-93-7
77-79-2.asp 77-79-2
71-36-3.asp 71-36-3
106-97-8.asp 106-97-8
107-92-6.asp 107-92-6
71-36-3.asp 71-36-3
71-36-3.asp 71-36-3
112-34-5.asp 112-34-5
109-72-8.asp 109-72-8
1118-46-3.asp 1118-46-3
128-37-0.asp 128-37-0
109-72-8.asp 109-72-8 110-54-3
109-72-8.asp 109-72-8
109-79-5.asp 109-79-5
Butyltin_hydroxide_oxide.asp N/A
1118-46-3.asp 1118-46-3
3068-88-0.asp 3068-88-0
109-74-0.asp 109-74-0
141-75-3.asp 141-75-3
6131-99-3.asp 6131-99-3
561-20-6.asp 561-20-6
7440-43-9.asp 7440-43-9
7440-43-9.asp 7440-43-9
7697-37-2.asp 7697-37-2 7440-43-9
10108-64-2.asp 10108-64-2
10108-64-2.asp 10108-64-2
10022-68-1.asp 10022-68-1
1306-19-0.asp 1306-19-0
10124-36-4.asp 10124-36-4
1306-25-8.asp 1306-25-8
7647-17-8.asp 7647-17-8
331-39-5.asp 331-39-5
58-08-2.asp 58-08-2
1461-15-0.asp 1461-15-0
3810-39-7.asp 3810-39-7
7440-70-2.asp 7440-70-2
62-54-4.asp 62-54-4 64-19-7
7789-41-5.asp 7789-41-5


HBCChem,Inc

Chemical Information Net chemcas.orgCopyright Reserved

Trading Lead

Leputech HPLC Laboratory