AG01DU4R

1359722-13-6 | (2S)-2-AMINO-3-(3-CHLOROPHENYL)PROPAN-1-OL hydrochloride

AG01DU4R

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CAS Number	1359722-13-6
Catalog Number	AG01DU4R
Chemical Name	(2S)-2-AMINO-3-(3-CHLOROPHENYL)PROPAN-1-OL hydrochloride
IUPAC Name	(2S)-2-amino-3-(3-chlorophenyl)propan-1-ol;hydrochloride
InChI	InChI=1S/C9H12ClNO.ClH/c10-8-3-1-2-7(4-8)5-9(11)6-12;/h1-4,9,12H,5-6,11H2;1H/t9-;/m0./s1
InChI Key	PCMUNXWULDZUCG-FVGYRXGTSA-N
MDL Number	MFCD29477540
Molecular Formula	C9H13Cl2NO
Molecular Weight	222.1116
SMILES	OC[C@@H](N)CC1=CC=CC(Cl)=C1.[H]Cl
Synonyms	(S)-2-Amino-3-(3-chlorophenyl)propan-1-ol hydrochloride, 1217859-58-9, KS-00000TAY, DS-10026, DB-016855, MFCD11505664, (S)-beta-(3-Chlorophenyl)alaninol hydrochloride,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	221.037g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	222.109g/mol
Monoisotopic Mass	221.037g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number