AG0096D5

1085842-51-8 | Trans-(1S,2S)-Methyl 3-aMinocyclopentanecarboxylate hydrochlorid

AG0096D5

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CAS Number	1085842-51-8
Catalog Number	AG0096D5(AGN-PC-0WAMBR)
Chemical Name	Trans-(1S,2S)-Methyl 3-aMinocyclopentanecarboxylate hydrochlorid
IUPAC Name	methyl (1S,3S)-3-aminocyclopentane-1-carboxylate;hydrochloride
InChI	InChI=1S/C7H13NO2.ClH/c1-10-7(9)5-2-3-6(8)4-5;/h5-6H,2-4,8H2,1H3;1H/t5-,6-;/m0./s1
InChI Key	CKMCJNXERREXFB-GEMLJDPKSA-N
MDL Number	MFCD23106008
Molecular Formula	C7H14ClNO2
Molecular Weight	179.6446
SMILES	O=C([C@@H]1C[C@@H](N)CC1)OC.[H]Cl
Synonyms	1085842-51-8, (1S,3S)-methyl 3-aminocyclopentanecarboxylate hydrochloride, methyl (1S,3S)-3-aminocyclopentane-1-carboxylate hydrochloride, (1S,3S)-Methyl 3-aminocyclopentanecarboxylate HCl, methyl trans-3-aminocyclopentane-1-carboxylate hydrochloride, CKMCJNXERREXFB-GEMLJDPKSA-N, AK173650, SCHEMBL1178380, MFCD23106008, AKOS025404654, PB38858, SB20708, SB20709, KS-000007I7, AS-51795, CS-0058623, Q-4047, Trans-(1S,2S)-Methyl 3-aMinocyclopentanecarboxylate hydrochlorid, (1s, 3s)-3-aminocyclopentanecarboxylic acid methyl ester hydrochloride, (1S,3S)-3-amino-cyclopentanecarboxylic acid methyl ester hydrochloride, Trans-Methyl 3-aMinocyclopentanecarboxylate hydrochloride, 222530-45-2, methyl (1R,3R)-3-aminocyclopentane-1-carboxylate hydrochloride, 489446-79-9,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	179.071g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	179.644g/mol
Monoisotopic Mass	179.071g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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