AG0039IZ

521284-21-9 | R-2-((4-nitrophenethyl)amino)-1-phenylethan-1-ol hydrochloride

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CAS Number	521284-21-9
Catalog Number	AG0039IZ(AGN-PC-0SC55K)
Chemical Name	R-2-((4-nitrophenethyl)amino)-1-phenylethan-1-ol hydrochloride
IUPAC Name	(1R)-2-[2-(4-nitrophenyl)ethylamino]-1-phenylethanol;hydrochloride
InChI	InChI=1S/C16H18N2O3.ClH/c19-16(14-4-2-1-3-5-14)12-17-11-10-13-6-8-15(9-7-13)18(20)21;/h1-9,16-17,19H,10-12H2;1H/t16-;/m0./s1
InChI Key	LUAUJCGKCGBAKA-NTISSMGPSA-N
MDL Number	MFCD26407510
Molecular Formula	C16H19ClN2O3
Molecular Weight	322.7867
SMILES	O[C@H](C1=CC=CC=C1)CNCCC2=CC=C([N+]([O-])=O)C=C2.[H]Cl
Synonyms	521284-21-9, (R)-2-((4-Nitrophenethyl)amino)-1-phenylethanol hydrochloride, (1R)-2-[2-(4-nitrophenyl)ethylamino]-1-phenylethanol hydrochloride, (R)-alpha-[[(4-Nitrophenethyl)amino]methyl]benzyl Alcohol Hydrochloride, (alphaR)-alpha-[[[2-(4-Nitrophenyl)ethyl]amino]methyl]benzenemethanol hydrochloride, LUAUJCGKCGBAKA-NTISSMGPSA-N, AK137357, SCHEMBL1405434, KS-00000RPZ, DTXSID20736218, AKOS022171673, DS-5837, AC-26411, AX8258925, (R)-2-(4-nitrophenethylamino)-1-phenylethanol hydrochloride, R-2-((4-nitrophenethyl)amino)-1-phenylethan-1-ol hydrochloride, (R)-2-[[2-(4-nitrophenyl)ethyl]amino]-1-phenylethanol monohydrochloride, (1R)-2-{[2-(4-Nitrophenyl)ethyl]amino}-1-phenylethan-1-ol--hydrogen chloride (1/1), (R)-2-((4-Nitrophenethyl)amino)-1-phenylethanol hydrochloride;(R)-2-((4-nitrophenethyl)amino)-1-phenylethanol hydrochloride, ACN-054095, (1R)-2-[2-(4-nitrophenyl)ethylamino]-1-phenylethanol,hydrochloride, BenzeneMethanol, -[[[2-(4-nitrophenyl)ethyl]aMino]Methyl]-, (R)-, (alphaR)-alpha-[[[2-(4-Aminophenyl)ethyl]amino]methyl]benzenemethanol hydrochloride, 521284-22-0,

Complexity	305
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	322.108g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	322.789g/mol
Monoisotopic Mass	322.108g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	78.1A^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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