CAS 496-41-3|Benzofuran-2-carboxylic acid

Introduction:Basic information about CAS 496-41-3|Benzofuran-2-carboxylic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameBenzofuran-2-carboxylic acid
CAS Number496-41-3Molecular Weight162.14200
Density/Boiling Point310-315°C
Molecular FormulaC9H6O3Melting Point193-196 °C(lit.)
MSDS/Flash Point310-315°C

Names

NameBenzofuran-2-carboxylic acid
SynonymMore Synonyms

Chemical & Physical Properties

Boiling Point310-315°C
Melting Point193-196 °C(lit.)
Molecular FormulaC9H6O3
Molecular Weight162.14200
Flash Point310-315°C
Exact Mass162.03200
PSA50.44000
LogP2.13100
Vapour Pressure0mmHg at 25°C
Index of Refraction1.649
InChIKeyOFFSPAZVIVZPHU-UHFFFAOYSA-N
SMILESO=C(O)c1cc2ccccc2o1
Water Solubilitypartially soluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF6490000
CHEMICAL NAME :
2-Benzofurancarboxylic acid
CAS REGISTRY NUMBER :
496-41-3
BEILSTEIN REFERENCE NO. :
0124204
LAST UPDATED :
199709
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H6-O3
MOLECULAR WEIGHT :
162.15
WISWESSER LINE NOTATION :
T56 BOJ CVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,7,1953
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02495

Safety Information

Hazard CodesXi:Irritant;
Risk PhrasesR36/37/38
Safety PhrasesS26-S37/39
WGK Germany3
RTECSDF6490000
HS Code29329985

Customs

HS Code29329985

Synonyms

Coumarilic Acid
MFCD00005848
EINECS 207-818-9
Benzofuran-2-carboxylic Acid
Benzo[b]furan-2-carboxylic acid
Coumarone-2-carboxylic Acid
1-benzofuran-2-carboxylic acid
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