AG0022S2

18125-46-7 | D-Phenylalanine, 4-fluoro-

AG0022S2

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CAS Number	18125-46-7
Catalog Number	AG0022S2(AGN-PC-0O54O0)
Chemical Name	D-Phenylalanine, 4-fluoro-
IUPAC Name	(2R)-2-amino-3-(4-fluorophenyl)propanoic acid
InChI	InChI=1S/C9H10FNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
InChI Key	XWHHYOYVRVGJJY-MRVPVSSYSA-N
MDL Number	MFCD00063063
Molecular Formula	C9H10FNO2
Molecular Weight	183.1796
SMILES	O=C(O)[C@H](N)CC1=CC=C(F)C=C1
UNII	963G7O1PVE
Synonyms	4-Fluoro-D-phenylalanine, 18125-46-7, D-4-Fluorophenylalanine, H-D-Phe(4-F)-OH, (R)-2-Amino-3-(4-fluorophenyl)propanoic acid, p-Fluoro-D-phenylalanine, D-PHENYLALANINE, 4-FLUORO-, UNII-963G7O1PVE, (2R)-2-amino-3-(4-fluorophenyl)propanoic acid, D-4-FLUOROPHE, 963G7O1PVE, MFCD00063063, 4-Fluorophenylalanine, D-, 4-fluor-d-phenylalanin, (R)-4-FLUOROPHENYLALANINE, R-(+)-4-Fluorophenylalanine, PubChem17502, PubChem17965, AC1LEQE0, D-4-Fluoro phenylalanine, Lopac-F-4646, AC1Q4NO3, D-4-F-PHE-OH, SCHEMBL72793, KSC174O9L, CHEMBL1434241, H-D-Phe(4-F)-OH .HCl, CTK0H4795, XWHHYOYVRVGJJY-MRVPVSSYSA-N, ZINC113781, ACN-S002987, KS-00000FL2, ANW-44103, CF-337, AB02498, AC-5834, AM83344, NCGC00015435-01, AJ-11453, AS-14702, M243, SC-10781, AB0015134, TC-132848, TL8001451, F0901, FT-0613669, ST24035314, M-2554, (2R)-2-amino-3-(4-fluorophenyl)propionic acid, (2R)-2-azanyl-3-(4-fluorophenyl)propanoic acid, 125P467, I01-6938, Q-101536, UNII-42T8578M1E component XWHHYOYVRVGJJY-MRVPVSSYSA-N, UNII-4JDT453NWO component XWHHYOYVRVGJJY-MRVPVSSYSA-N, p-Fluoro-D-phenylalanine, >=99.0% (sum of enantiomers, HPLC), Alnasid, p-Fluoro-L-phenylalanine, 1,8-ANS magnesium salt, D,L-p-Fluorophenylalanine, l-4-fluoro-phenyl-alanine, H-D-Phe(4-F)-OH.HCl, 4-FLUORO-L-PHENYLALANINE, C9H10FNO2, 4-FLUORO-DL-PHENYLALANINE, AR-1G2287, CID716314, MFCD00063064, ACN-026116, 4-Fluoro-D-phenylalanine, 98% - 1G 1g, A7532, (2S)-2-amino-3-(4-fluorophenyl)propanoic acid, 1132-68-9, 122839-52-5, 51-65-0, 51944-00-4,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	183.07g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	183.182g/mol
Monoisotopic Mass	183.07g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.9

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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