AG004XSP

82769-76-4 | (S)-3-Amino-3-phenylpropan-1-ol

AG004XSP

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CAS Number	82769-76-4
Catalog Number	AG004XSP(AGN-PC-0UN7XE)
Chemical Name	(S)-3-Amino-3-phenylpropan-1-ol
IUPAC Name	(3S)-3-amino-3-phenylpropan-1-ol
InChI	InChI=1S/C9H13NO/c10-9(6-7-11)8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m0/s1
InChI Key	SEQXIQNPMQTBGN-VIFPVBQESA-N
MDL Number	MFCD01311768
Molecular Formula	C9H13NO
Molecular Weight	151.2056
SMILES	OCC[C@H](N)C1=CC=CC=C1
Synonyms	(S)-3-Amino-3-phenylpropan-1-ol, 82769-76-4, (s)-1-phenyl-3-propanolamine, (3S)-3-amino-3-phenylpropan-1-ol, (s)-beta-phenylalaninol, (s)-3-phenyl-beta-alaninol, (s)-3-amino-3-phenyl-propan-1-ol, (3S)-3-amino-3-phenyl-propan-1-ol, (S)-3-Amino-3-phenyl-1-propanol, Q-200035, (S)-3-Amino-3-phenylpropan-1-ol, 95%, 98% ee, AK-36482, MFCD01311768, PubChem13854, AC1MC1BO, KSC491Q5N, (S)-1-Phenyl-3-propanolamin, SCHEMBL1454854, CTK3J1856, KS-00000MRQ, S-3-amino-3-phenylpropan-1-ol, DTXSID90370345, SEQXIQNPMQTBGN-VIFPVBQESA-N, (S)-1-phenyl-3-hydroxypropylamine, ACT03211, BCP28027, ZINC2243698, (s)-3-amino-3-phenyl propan-1-ol, 2792AC, AC-071, ANW-54196, CP-493, FCH949931, (3S)-3-amino-3-phenyl-1-propanol, AKOS015854099, (S)-3-AMINO-3-PHENYLPROPANOL, CS-W002754, DS-1777, EBD2202905, RTR-025863, AJ-34376, AN-16144, BC202108, CC-01327, I075, SC-24748, Benzenepropanol, gamma-amino-, (gammaS)-, AX8006964, DB-013680, ST2414628, TR-025863, FT-0630325, 69A764, M-9063, C-02975, (S)-?-Phenylalaninol, C11H14ClNO, C9H13NO, ACN-039895, CB11692, CID2734520, BRN 0509667, (S)-3-Amino-3-phenyl-1-propanol, 97% 1g, A10055, 1-(1,2,3,4-Tetrahydroisoquinolin-7-yl)ethanone hydrochloride, (S)-3-Amino-3-phenyl-1-propanol, 98%, ee: 98% - 250MG 250mg, 82771-27-5,

Complexity	99.7
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	3
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	8
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3259

Certificate of Analysis

Lot Number