AG001LUS

149597-91-1 | D-Phenylalanine, β-phenyl-

AG001LUS

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CAS Number	149597-91-1
Catalog Number	AG001LUS(AGN-PC-0Q3INC)
Chemical Name	D-Phenylalanine, β-phenyl-
IUPAC Name	(2R)-2-amino-3,3-diphenylpropanoic acid
InChI	InChI=1S/C15H15NO2/c16-14(15(17)18)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H,16H2,(H,17,18)/t14-/m1/s1
InChI Key	PECGVEGMRUZOML-CQSZACIVSA-N
MDL Number	MFCD01631990
Molecular Formula	C15H15NO2
Molecular Weight	241.2851
SMILES	O=C(O)[C@H](N)C(C1=CC=CC=C1)C2=CC=CC=C2
UNII	H2JAP020MP
Synonyms	149597-91-1, 3,3-Diphenyl-D-alanine, (R)-2-amino-3,3-diphenylpropanoic acid, D-3,3-Diphenylalanine, (2R)-2-amino-3,3-diphenylpropanoic acid, UNII-H2JAP020MP, H2JAP020MP, D-Phenylalanine, beta-phenyl-, (2R)-2-amino-3,3-diphenyl-propanoic acid, (2R)-2-amino-3,3-diphenyl-propionic acid, (2R)-2-azanyl-3,3-diphenyl-propanoic acid, (R)-2-Amino-3,3-diphenylpropionic acid, AK111229, (R)-Diphenylalanine, PubChem18699, beta-Phenyl-D-phenylalanine, AC1LU53H, SCHEMBL502830, CTK8C5989, KS-00000IWJ, ZINC4204156, ZX-AT014758, CD-708, MFCD01631990, SBB067472, AKOS015912122, AC-4456, DS-5145, OR14743, AJ-48702, M239, AB0015132, AX8018477, DB-038085, TL8001078, TR-006071, FT-0653195, ST24035293, 3,3-Diphenyl-D-alanine, >=98.0% (HPLC), K-4757, 597D911, I14-3607, UNII-JZ0RRY1Q3S component PECGVEGMRUZOML-CQSZACIVSA-N, D-DiPhenylalanine, L-3,3'-Biphenylalanine, C15H15NO2, NSC13903, (S)-2-amino-3,3-diphenylpropanoic acid, ACN-026187, CID1520861, (R)-2-Amino-3,3-diphenylpropanoicacid, (2S)-2-amino-3,3-diphenylpropanoic acid, (S)-2-Amino-3,3-diphenylpropanoic acid hydrochloride, 149597-92-2,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	241.11g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	241.29g/mol
Monoisotopic Mass	241.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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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