AG0038C8

1099646-61-3 | (S)-Methyl pyrrolidine-3-carboxylate HCl

AG0038C8

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CAS Number	1099646-61-3
Catalog Number	AG0038C8(AGN-PC-0WA31B)
Chemical Name	(S)-Methyl pyrrolidine-3-carboxylate HCl
IUPAC Name	methyl (3S)-pyrrolidine-3-carboxylate;hydrochloride
InChI	InChI=1S/C6H11NO2.ClH/c1-9-6(8)5-2-3-7-4-5;/h5,7H,2-4H2,1H3;1H/t5-;/m0./s1
InChI Key	VVBSXSVVMNGQIN-JEDNCBNOSA-N
MDL Number	MFCD11840196
Molecular Formula	C6H12ClNO2
Molecular Weight	165.6180
SMILES	COC(=O)[C@@H]1CNCC1.Cl
Synonyms	(S)-Methyl pyrrolidine-3-carboxylate hydrochloride, 1099646-61-3, methyl (3S)-pyrrolidine-3-carboxylate hydrochloride, AK-65093, (S)-methyl pyrrolidine-3-carboxylate HCL, SCHEMBL17364117, CTK8B5033, DTXSID40705466, VVBSXSVVMNGQIN-JEDNCBNOSA-N, ACT01737, ANW-47140, HT1110, MFCD11840196, AKOS015919638, CS-W005089, GS-3836, SB10232, KS-0000033T, methyl (S)-pyrrolidine-3-carboxlate HCl, BR-65093, AB0034731, AX8217352, DB-059955, ST2408357, TC-135885, FT-0687382, X8929, S-6819, methyl (3S)-3-pyrrolidinecarboxylate hydrochloride, (3S)-3-PYRROLIDINECARBOXYLIC ACID METHYL ESTER HCL, S-3-Pyrrolidinecarboxylic acid methyl ester hydrochloride, 1099646-61-3 (S)-methyl pyrrolidine-3-carboxylate Hydrochloride, Methyl (3S)-pyrrolidine-3-carboxylate--hydrogen chloride (1/1), C6H12ClNO2, methyl pyrrolidine-3-carboxylate hydrochloride, methyl (3R)-pyrrolidine-3-carboxylate hydrochloride, 198959-37-4, 874964-22-4,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	165.056g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	165.617g/mol
Monoisotopic Mass	165.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.3A^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-P305+P351+P338
UN Code

Certificate of Analysis

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