AG00HVDV

1391506-22-1 | (2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl

AG00HVDV

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CAS Number	1391506-22-1
Catalog Number	AG00HVDV(AGN-PC-0WNGJ8)
Chemical Name	(2S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl
IUPAC Name	(2S)-2-amino-2-(3-chloro-2-fluorophenyl)ethanol;hydrochloride
InChI	InChI=1S/C8H9ClFNO.ClH/c9-6-3-1-2-5(8(6)10)7(11)4-12;/h1-3,7,12H,4,11H2;1H/t7-;/m1./s1
InChI Key	SEZRFYYOQSQCSP-OGFXRTJISA-N
MDL Number	MFCD12758365
Molecular Formula	C8H10Cl2FNO
Molecular Weight	226.0755
SMILES	FC1=C(Cl)C=CC=C1[C@H](N)CO.[H]Cl
Synonyms	1391506-22-1, (2S)-2-amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hcl, (S)-2-amino-2-(3-chloro-2-fluorophenyl)ethanol hydrochloride, SCHEMBL16397203, SEZRFYYOQSQCSP-OGFXRTJISA-N, KS-000026EP, MFCD12758365, AKOS030632945, GS-7244, (S)-2-Amino-2-(3-chloro-2-fluorophenyl)ethanol HCl, (2S)-2-amino-2-(3-chloro-2-fluorophenyl)ethan-1-ol hydrochloride,

Complexity	147
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	225.012g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	226.072g/mol
Monoisotopic Mass	225.012g/mol
Rotatable Bond Count	2
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
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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