AG002KHX

209963-05-3 | (2S)-2-Amino-2-(3-bromophenyl)ethan-1-ol

AG002KHX

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CAS Number	209963-05-3
Catalog Number	AG002KHX(AGN-PC-0QWZHO)
Chemical Name	(2S)-2-Amino-2-(3-bromophenyl)ethan-1-ol
IUPAC Name	(2S)-2-amino-2-(3-bromophenyl)ethanol
InChI	InChI=1S/C8H10BrNO/c9-7-3-1-2-6(4-7)8(10)5-11/h1-4,8,11H,5,10H2/t8-/m1/s1
InChI Key	NWQRKZFQSCBVEY-MRVPVSSYSA-N
MDL Number	MFCD09253669
Molecular Formula	C8H10BrNO
Molecular Weight	216.0751
SMILES	OC[C@@H](N)C1=CC=CC(Br)=C1
Synonyms	209963-05-3, (S)-2-amino-2-(3-bromophenyl)ethanol, (2S)-2-amino-2-(3-bromophenyl)ethan-1-ol, (S)-2-amino-2-(3-bromophenyl)ethan-1-ol, (S)-2-Amino-2-(3-bromophenyl)ethanol hydrochloride, (2S)-2-Amino-2-(3-bromophenyl)ethanol, AMGLY00005, SCHEMBL8515046, NWQRKZFQSCBVEY-MRVPVSSYSA-N, MFCD09253669, ZINC38124675, AKOS015928752, (S)-beta-Amino-3-bromo-benzeneethanol, AM85369, EBD3022516, FCH1414498, (betaS)-beta-Amino-3-bromobenzeneethanol, AK201496, AS-49504, SC-70769, AX8297216, CS-0036354, (S)-2-amino-2-(3-bromophenyl)-ethan-1-ol, Benzeneethanol, beta-amino-3-bromo-, (betaS)-, (S)-b-Amino-3-bromo-benzeneethanol, ACN-040961, 209963-04-2,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	214.995g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	216.078g/mol
Monoisotopic Mass	214.995g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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