Ethyl 2-amino-4-phenyl-3-thiophenecarboxylate

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Names

[ CAS No. ]:
4815-36-5

[ Name ]:
Ethyl 2-amino-4-phenyl-3-thiophenecarboxylate

[Synonym ]:
Ethyl 2-amino-4-phenylthiophene-3-carboxylate
3-Thiophenecarboxylic acid, 2-amino-4-phenyl-, ethyl ester
Ethyl 2-amino-4-phenyl-3-thiophenecarboxylate
MFCD00126391
2-Amino-4-phenyl-3-thiophenecarboxylic acid ethyl ester

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
391.0±42.0 °C at 760 mmHg

[ Melting Point ]:
95 - 97ºC

[ Molecular Formula ]:
C13H13NO2S

[ Molecular Weight ]:
247.313

[ Flash Point ]:
190.3±27.9 °C

[ Exact Mass ]:
247.066696

[ PSA ]:
80.56000

[ LogP ]:
4.06

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.612

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM8350000
CHEMICAL NAME :
Thiophene-3-carboxylic acid, 2-amino-4-phenyl-, ethyl ester
CAS REGISTRY NUMBER :
4815-36-5
BEILSTEIN REFERENCE NO. :
1429620
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H13-N-O2-S
MOLECULAR WEIGHT :
247.33
WISWESSER LINE NOTATION :
T5SJ BZ CVO2 DR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,563,1980

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
22

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2934999090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Acetophenone
  • Ethyl cyanoacetate
  • morpholine
  • ethyl α-cyano-β-methylcinnamate

DownStream

  • 5-phenylthieno[2,3-d]pyrimidin-4-ol
  • 2,5-diphenyl-3H-thieno[2,3-d]pyrimidin-4-one
  • 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
  • 4-chloro-2,5-diphenylthieno[2,3-d]pyrimidine
  • ethyl 2-(methylcarbamothioylamino)-4-phenylthiophene-3-carboxylate
  • 3-methyl-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one
  • 4-chloro-5-phenylthieno[2,3-d]pyrimidine
  • 5-phenyl-2-[3-(trifluoromethyl)phenyl]-3H-thieno[2,3-d]pyrimidin-4-one
  • 4-phenyl-5H-thiophen-2-one
  • ethyl 2-[(4-chlorobenzoyl)amino]-4-phenylthiophene-3-carboxylate

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%

Related Compounds

  • Ethyl 2-amino-5-chloro-4-phenyl-3-thiophenecarboxylate
  • Ethyl 2-[(3-chloropropanoyl)amino]-4-phenyl-3-thiophenecarboxylate
  • ethyl 2-{[(2-methylphenoxy)acetyl]amino}-4-phenyl-3-thiophenecarboxylate
  • ethyl 2-{[(4-chlorophenoxy)acetyl]amino}-4-phenyl-3-thiophenecarboxylate
  • 18-hydroxycortisol
  • 2-amino-4-(3-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester
  • (2R)-2-{[5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-1H-1,2,4-triazol-3-yl]formamido}-4-methylpentanoic acid
  • 4-(Tert-butoxy)-2-methoxybutanoic acid
  • 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methylpyridine-3-carboxylic acid
  • 5-Bromo-3-nitro-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole
  • 2-[5-Chloro-2-(difluoromethoxy)phenyl]oxirane
  • 4-(aminomethyl)-4-(1-ethyl-1H-pyrazol-5-yl)cyclohexan-1-ol
  • 2,2-dimethyl-3-(trimethyl-1H-pyrazol-4-yl)propan-1-ol
  • Methyl 5-(2-cyanoethyl)-2-hydroxybenzoate
  • 2-(3-Bromo-5-methylthiophen-2-yl)-2-methylpropan-1-amine
  • (5-Bromothiophen-3-yl)methanesulfonamide
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