AG007IFF

31823-64-0 | Ethyl 3-aminothiophene-2-carboxylate

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CAS Number	31823-64-0
Catalog Number	AG007IFF(AGN-PC-0N1ID8)
Chemical Name	Ethyl 3-aminothiophene-2-carboxylate
IUPAC Name	ethyl 3-aminothiophene-2-carboxylate
InChI	InChI=1S/C7H9NO2S/c1-2-10-7(9)6-5(8)3-4-11-6/h3-4H,2,8H2,1H3
InChI Key	VSRVNHPIXCUMIA-UHFFFAOYSA-N
MDL Number	MFCD09953566
Molecular Formula	C7H9NO2S
Molecular Weight	171.2169
SMILES	O=C(C1=C(N)C=CS1)OCC
Synonyms	Ethyl 3-aminothiophene-2-carboxylate, 31823-64-0, 2-Thiophenecarboxylic acid, 3-amino-, ethyl ester, amino(ethoxycarbonyl)thiophene, SCHEMBL930157, CTK8C0311, DTXSID70437440, VSRVNHPIXCUMIA-UHFFFAOYSA-N, ANW-64481, MFCD09953566, ZINC26506189, AKOS010564140, AB55410, QC-5896, RP23354, AJ-82469, AS-35597, Ethyl 3-aminothiophene-2-carboxylate,97%, AB0073455, DB-068530, Ethyl 3-aminothiophene-2-carboxylate, 97%, TC-153226, FT-0687875, 3-Aminothiophene-2-carboxylic acid ethyl ester, 3-Amino-thiophene-2-carboxylic acid ethyl ester, J-520851, F1903-0382, CID10261542, ETHYL3-AMINOTHIOPHENE-2-CARBOXYLATE, Ethyl 3-aminothiophene-2-carboxylate, 97% - 1G 1g, 22288-78-4,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.035g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.214g/mol
Monoisotopic Mass	171.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	80.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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