AG00CM1Z

327183-90-4 | (2S)-2-AMino-2-(4-Methylphenyl)ethan-1-ol

AG00CM1Z

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CAS Number	327183-90-4
Catalog Number	AG00CM1Z(AGN-PC-0R83VK)
Chemical Name	(2S)-2-AMino-2-(4-Methylphenyl)ethan-1-ol
IUPAC Name	(2S)-2-amino-2-(4-methylphenyl)ethanol
InChI	InChI=1S/C9H13NO/c1-7-2-4-8(5-3-7)9(10)6-11/h2-5,9,11H,6,10H2,1H3/t9-/m1/s1
InChI Key	JTEURNIHEPFUIJ-SECBINFHSA-N
MDL Number	MFCD09253778
Molecular Formula	C9H13NO
Molecular Weight	151.2056
SMILES	CC1=CC=C([C@H](N)CO)C=C1
Synonyms	(S)-2-Amino-2-(p-tolyl)ethanol, 327183-90-4, (2S)-2-amino-2-(4-methylphenyl)ethan-1-ol, (2S)-2-amino-2-(4-methylphenyl)ethanol, AC1OXTVM, SCHEMBL17619269, JTEURNIHEPFUIJ-SECBINFHSA-N, ZINC6658340, FCH866328, MFCD09253778, AKOS006331181, AKOS015928146, (S)-beta-Amino-4-methyl-benzeneethanol, AK162059, (betaS)-beta-Amino-4-methylbenzeneethanol, 2-amino-2-(4-methylphenyl)ethanol, (S)-b-Amino-4-methyl-benzeneethanol, CID8027557,

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	151.1g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	151.209g/mol
Monoisotopic Mass	151.1g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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

Lot Number