AG001FX7

141109-19-5 | Benzeneacetic acid, 2-chloro-α-[[2-(2-thienyl)ethyl]amino]-, methyl ester, hydrochloride (1:1), (αS)-

AG001FX7

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CAS Number	141109-19-5
Catalog Number	AG001FX7(AGN-PC-0PQASM)
Chemical Name	Benzeneacetic acid, 2-chloro-α-[[2-(2-thienyl)ethyl]amino]-, methyl ester, hydrochloride (1:1), (αS)-
EC Number	604-219-8
IUPAC Name	methyl (2S)-2-(2-chlorophenyl)-2-(2-thiophen-2-ylethylamino)acetate;hydrochloride
InChI	InChI=1S/C15H16ClNO2S.ClH/c1-19-15(18)14(12-6-2-3-7-13(12)16)17-9-8-11-5-4-10-20-11;/h2-7,10,14,17H,8-9H2,1H3;1H/t14-;/m0./s1
InChI Key	ZXANKCFSGFEBQW-UQKRIMTDSA-N
MDL Number	MFCD08460122
Molecular Formula	C15H17Cl2NO2S
Molecular Weight	346.2720
SMILES	O=C(OC)[C@H](C1=CC=CC=C1Cl)NCCC2=CC=CS2.[H]Cl
Synonyms	141109-19-5, (S)-Methyl 2-(2-chlorophenyl)-2-((2-(thiophen-2-yl)ethyl)amino)acetate hydrochloride, Q-101329, D-(+)-Methyl-alpha-(2-Thienylethamino)(2-Chlorophenyl)acetateHydrochloride, S-(+)-Methyl-(2-chlorophenyl)[(2-(2-thienyl)amino] acetate hydrochloride, PubChem22110, SCHEMBL1808015, CTK8B4612, ZXANKCFSGFEBQW-UQKRIMTDSA-N, ANW-45661, MFCD08458449, AKOS015918445, RL01728, AK-86897, C134, SC-26701, AX8123253, TC-134406, ST24026644, 109S208, I14-8109, D-(+)-Methyl-alpha-(2-thienylethamino)(2-chlorophe, (+)-methyl-alpha-(2-thienylethamino)(2-chlorophenyl)acetatehydrochloride, d-(+)-methyl-(2-thienylethamino)(2-chlorophenyl)acetate hydrochloride, D-(+)-Methyl--(2-thienylethamino)(2-chlorophenyl)acetate hydrochloride, D-(+)-Methyl-alpha-(2-thienylethamino)(2-chlorophenyl)acetate?hydrochloride, d-(+)-n-(2-(2-thienyl)ethyl)-2-chlorophenyl glycine methyl ester hcl, (S)-methyl 2-(2-chlorophenyl)-2-(2-(thiophen-2-yl)ethylamino)acetate hydrochloride, methyl (2s)-(2-chlorophenyl)[(2-thien-2-yl ethyl)amino]acetate hydrochloride, Benzeneacetic acid, 2-chloro-alpha-[[2-(2-thienyl)ethyl]amino]-, methyl ester, hydrochloride (1:1), (alphaS)-, ACN-040132, CB11991, D-(+)-Methyl-alpha-(2-thienylethamino)(2-chlorophenyl)acetate hydrochloride, (S)-N-[2-(2-Thienyl)ethyl]-2-chlorophenyl glycine methyl ester HCl, S(+)-N-(2-(2-Thienyl)Ethyl)-2-Chlorophenyl Glycine Methyl Ester HCl, 2-Chloro-N-[2-(2-thienyl)ethyl]-D-phenylglycine methyl ester hydrochloride, d-(+)-methyl-a-(2-thienylethamino)(2-chlorophenyl)acetate hydrochloride, S-(+)-Methyl-(2-chlorophenyl)[(2-(2-thienyl)amino] acetate hydrochloride, 98% 250mg, 141109-20-8,

Complexity	316
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	345.036g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	346.266g/mol
Monoisotopic Mass	345.036g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	66.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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