AG003760

4815-36-5 | Ethyl-2-amino-4-phenylthiophene-3-carboxylate

AG003760

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CAS Number	4815-36-5
Catalog Number	AG003760(AGN-PC-0JLB04)
Chemical Name	Ethyl-2-amino-4-phenylthiophene-3-carboxylate
IUPAC Name	ethyl 2-amino-4-phenylthiophene-3-carboxylate
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
InChI Key	WYTHTMKMOSPACP-UHFFFAOYSA-N
MDL Number	MFCD00126391
Molecular Formula	C13H13NO2S
Molecular Weight	247.3128
SMILES	C(C)OC(=O)C1=C(SC=C1C1=CC=CC=C1)N
Synonyms	Ethyl 2-amino-4-phenylthiophene-3-carboxylate, 4815-36-5, 2-Amino-4-phenyl-thiophene-3-carboxylic acid ethyl ester, ethyl 2-amino-4-phenyl-3-thiophenecarboxylate, 2-Amino-4-phenylthiophene-3-carboxylic acid ethyl ester, NSC149683, NSC 149683, BRN 1429620, Thiophene-3-carboxylic acid, 2-amino-4-phenyl-, ethyl ester, MFCD00126391, Amino-2 ethoxycarbonyl-3 phenyl-4 thiophene [French], 3-Thiophenecarboxylic acid, 2-amino-4-phenyl-, ethyl ester, Ethyl-2-amino-4-phenylthiophene-3-carboxylate, Ethyl 2-Amino-4-phenyl-thiophene-3-Carboxylate, 2-amino-4-phenyl-3-thiophenecarboxylic acid ethyl ester, CBMicro_024541, Enamine_004212, AC1L2JIY, Amino-2 ethoxycarbonyl-3 phenyl-4 thiophene, 5-18-12-00255 (Beilstein Handbook Reference), KSC590M9F, ARONIS24355, 2-Amino-4-Phenyl-Thiophene-3-CarboxylicAcidEthylEster, SCHEMBL1190649, CTK4J0692, DTXSID50197439, WYTHTMKMOSPACP-UHFFFAOYSA-N, HMS1405P10, ZINC117489, AC1Q3369, ALBB-001697, ANW-47185, BBL008315, NSC171773, SBB006987, STK347691, AKOS000112156, ACN-027362, CCG-241818, EBD2223701, MCULE-9089372542, NSC-149683, NSC-171773, RTR-017671, KS-000010J5, KS-0000470V, 2-amino-3-carboethoxy-4-phenylthiophene, AJ-11529, AK-35296, AS-43108, BAS 00435773, BR-35296, CJ-00846, SC-85530, ZB003912, 2-amino-3-ethoxycarbonyl-4-phenylthiophene, AB0025077, LS-152979, ST2406885, TR-017671, 4CH-017860, CS-0038271, FT-0625929, ST45053895, W6473, EN300-02862, S-2344, I09-1896, J-507880, 2-amino-4-phenyl-3-thiophenecarboxylic acidethyl ester, Ethyl 2-amino-4-phenylthiophene-3-carboxylate, 97%, Z56860274, 2-amino-4-phenyl-3-thiophenecarboxylic acid, ethyl ester, F1018-1557, 2-AMINO-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL, 3-Thiophenecarboxylicacid, 2-amino-4-phenyl-, ethyl ester, InChI=1/C13H13NO2S/c1-2-16-13(15)11-10(8-17-12(11)14)9-6-4-3-5-7-9/h3-8H,2,14H2,1H, C13H13NO2S, CID73242, C13-H13-N-O2-S, CID6614512, A7331, ethyl 2-amino-5-phenylthiophene-3-carboxylate, 2-Amino-4-phenyl-thiophene-3-carboxylic acid ethyl ester, 98% - 1G 1g,

Complexity	266
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.067g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	247.312g/mol
Monoisotopic Mass	247.067g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	80.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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