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Basic Information
CAS No.: 4815-36-5
Name: 2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER
Article Data: 40
Molecular Structure:
Molecular Structure of 4815-36-5 (2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER)
Formula: C13H13NO2S
Molecular Weight: 247.318
Synonyms: 2-Amino-3-(ethoxycarbonyl)-4-phenylthiophene;2-Amino-3-carboethoxy-4-phenylthiophene;Ethyl 2-amino-4-phenyl-3-thiophenecarboxylate;NSC 149683;NSC 171773;
Density: 1.231 g/cm3
Melting Point: 92-97 °C
Boiling Point: 391 °C at 760 mmHg
Flash Point: 190.3 °C
Appearance: Yellow Solid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 22
PSA: 80.56000
LogP: 3.75520
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  • Ethyl 2-Amino-4-phenylthiophene-3-carboxylate

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    4815-36-5

    Ethyl 2-Amino-4-phenylthiophene-3-carboxylate

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  • 2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER

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    4815-36-5

    2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER

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    FINETECH INDUSTRY LIMITED is a LONDON based CRO company providing drug discovery & development services to worldwide clients. FINETECH INDUSTRY LIMITED supplies the 2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER, CAS:4815-36-5 with the most

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  • Ethyl 2-Amino-4-phenylthiophene-3-carboxylate

  • Casno:

    4815-36-5

    Ethyl 2-Amino-4-phenylthiophene-3-carboxylate

    Min.Order: 1 Gram

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Chemistry

IUPAC Name: ethyl 2-amino-4-phenylthiophene-3-carboxylate 
Empirical Formula: C13H13NO2S
Molecular Weight: 247.3128g/mol
Structure of 3-Thiophenecarboxylicacid, 2-amino-4-phenyl-, ethyl ester (CAS NO.4815-36-5):

Index of Refraction: 1.612
Molar Refractivity: 69.87 cm3
Molar Volume: 200.8 cm3
Polarizability: 27.69×10-24cm3
Surface Tension: 50 dyne/cm
Density: 1.231 g/cm3
Flash Point: 190.3 °C
Enthalpy of Vaporization: 64.06 kJ/mol
Boiling Point: 391 °C at 760 mmHg
Vapour Pressure: 2.54E-06 mmHg at 25°C 
Canonical SMILES: CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)N
InChI: InChI=1S/C13H13NO2S/c1-2-16-13(15)11-10(8-17-12(11)14)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3
InChIKey: WYTHTMKMOSPACP-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 563, 1980.

Safety Profile

Hazard Codes: IrritantXi
HazardClass: IRRITANT 

Specification

  3-Thiophenecarboxylicacid, 2-amino-4-phenyl-, ethyl ester , its cas register number is 4815-36-5. It also can be called 2-Amino-4-phenylthiophene-3-carboxylic acid ethyl ester ; 5-18-12-00255 (Beilstein Handbook Reference) ; Amino-2 ethoxycarbonyl-3 phenyl-4 thiophene ; BRN 1429620 ; Ethyl 2-amino-4-phenylthiophene-3-carboxylate ; NSC 149683 .