AG00C88N

35212-85-2 | Methyl 3-Aminobenzo[b]thiophene-2-carboxylate

AG00C88N

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CAS Number	35212-85-2
Catalog Number	AG00C88N(AGN-PC-0JXED1)
Chemical Name	Methyl 3-Aminobenzo[b]thiophene-2-carboxylate
IUPAC Name	methyl 3-amino-1-benzothiophene-2-carboxylate
InChI	InChI=1S/C10H9NO2S/c1-13-10(12)9-8(11)6-4-2-3-5-7(6)14-9/h2-5H,11H2,1H3
InChI Key	VLHHEYMZLXKSQO-UHFFFAOYSA-N
MDL Number	MFCD00206744
Molecular Formula	C10H9NO2S
Molecular Weight	207.2490
SMILES	COC(=O)C1=C(N)C2=C(S1)C=CC=C2
Synonyms	35212-85-2, Methyl 3-aminobenzo[b]thiophene-2-carboxylate, methyl 3-amino-1-benzothiophene-2-carboxylate, benzo[b]thiophene-2-carboxylic acid, 3-amino-, methyl ester, MFCD00206744, 3-Aminobenzo[b]thiophene-2-carboxylic acid methyl ester, Methyl 3-aminobenzo[b]thiophene-2-carboxylate, 97%, AC1LI5FH, CBMicro_030710, AC1Q5ZM7, MLS000119671, AC1Q42I6, SCHEMBL1101766, CHEMBL1411761, DTXSID90358022, VLHHEYMZLXKSQO-UHFFFAOYSA-N, HMS2251M09, ZINC442804, ALBB-028264, KS-00001ZP3, 2-carbomethoxy-3-aminobenzothiophene, 4358AB, ANW-71859, BBL005399, SBB093875, STK411269, AKOS001187243, 7P-368S, CCG-139771, MCULE-7495808490, AJ-22907, AK-65277, SMR000096592, ZB014088, BIM-0030704.P001, methyl 3-aminobenzothiophene-2-carboxylate, methyl-3-aminobenzothiophene-2-carboxylate, TC-160604, FT-0750964, H2654, ST50927827, 3-Amino-2-(methoxycarbonyl)-1-benzothiophene, EN300-15203, methyl 3-amino-benzo[b]thiophene-2-carboxylate, methyl 3-azanyl-1-benzothiophene-2-carboxylate, A822651, amino-benzo[b]thiophene-2-carboxylic acid methyl ester, 3-amino-1-benzothiophene-2-carboxylic acid methyl ester, 3-Amino-benzo[b]thiophene-2-carboxylic acid methyl ester, F0806-0001, Z119992490, 3-amino-benzo[b]thiophene-2-carboxylic acid, methyl ester, 6132-41-8, C10H9NO2S, AR-1J5100, CID874720, ZINC00442804, 61792-31-2,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.035g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.247g/mol
Monoisotopic Mass	207.035g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	80.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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