3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester

Modify Date: 2024-03-09 20:13:10

3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester Structure
3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester structure
Common Name 3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester
CAS Number 78033-82-6 Molecular Weight 305.34900
Density 1.351g/cm3 Boiling Point 420.3ºC at 760 mmHg
Molecular Formula C15H15NO4S Melting Point N/A
MSDS N/A Flash Point 208ºC

 Names

Name 2-hydroxyethyl 2-benzamido-5-methylthiophene-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.351g/cm3
Boiling Point 420.3ºC at 760 mmHg
Molecular Formula C15H15NO4S
Molecular Weight 305.34900
Flash Point 208ºC
Exact Mass 305.07200
PSA 107.36000
LogP 2.84190
Index of Refraction 1.645
InChIKey TWRLZPREVIRNOK-UHFFFAOYSA-N
SMILES Cc1cc(C(=O)OCCO)c(NC(=O)c2ccccc2)s1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM8370000
CHEMICAL NAME :
3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester
CAS REGISTRY NUMBER :
78033-82-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H15-N-O4-S
MOLECULAR WEIGHT :
305.37

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 14,861,1980

 Safety Information

HS Code 2934999090

 Synthetic Route

~85%

3-Thiophenecarboxylic acid, 2-(benzoylamino)-5-methyl-, 2-hydroxyethyl ester Structure

3-Thiophenecarb...

CAS#:78033-82-6

Literature: Kharizomenova, I. A.; Grinev, A. N.; Samsonova, N. V.; Kaplina, N. V.; Kapustina, M. V.; et al. Pharmaceutical Chemistry Journal, 1980 , vol. 14, # 12 p. 861 - 863 Khimiko-Farmatsevticheskii Zhurnal, 1980 , vol. 14, # 12 p. 42 - 45

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

3-Thiophenecarboxylic acid,2-(benzoylamino)-5-methyl-,2-hydroxyethyl ester
2-Hydroxyethyl 2-(benzoylamino)-5-methyl-3-thiophenecarboxylate
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