AG00AC68

169383-17-9 | D-2-NITROPHENYLALANINE

AG00AC68

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CAS Number	169383-17-9
Catalog Number	AG00AC68(AGN-PC-0Q9GNE)
Chemical Name	D-2-NITROPHENYLALANINE
IUPAC Name	(2R)-2-amino-3-(2-nitrophenyl)propanoic acid
InChI	InChI=1S/C9H10N2O4/c10-7(9(12)13)5-6-3-1-2-4-8(6)11(14)15/h1-4,7H,5,10H2,(H,12,13)/t7-/m1/s1
InChI Key	SDZGVFSSLGTJAJ-SSDOTTSWSA-N
MDL Number	MFCD00270361
Molecular Formula	C9H10N2O4
Molecular Weight	210.1867
SMILES	O=C(O)[C@H](N)CC1=CC=CC=C1[N+]([O-])=O
Synonyms	169383-17-9, (R)-2-Amino-3-(2-nitrophenyl)propanoic acid, 2-Nitro-D-phenylalanine, D-2-NITROPHENYLALANINE, D-2-NO2-Phe-OH, D-2-Nitrophe, (2R)-2-amino-3-(2-nitrophenyl)propanoic acid, AC1OCT0S, SCHEMBL8977587, CTK8B8730, ZINC2046239, ZX-AT014730, ANW-61135, MFCD00270361, AM83437, OR14706, AJ-33407, AS-41656, BBV-45071485, AX8018814, DB-021447, TR-007397, FT-0697807, ST24035303, B-7427, 383N179, NSC21949, ACN-034062, CID7000154, (R)-2-Amino-3-(2-nitrophenyl)propanoicacid, (r)-amino-3-(2-nitro-phenyl)-propionic acid, (2S)-2-amino-3-(2-nitrophenyl)propanoic acid, 19883-75-1, 756814-14-9,

Complexity	251
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	210.064g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	210.189g/mol
Monoisotopic Mass	210.064g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.6

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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