AG00HBOH

110117-84-5 | D-Phenylalanine, 3-fluoro-

AG00HBOH

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CAS Number	110117-84-5
Catalog Number	AG00HBOH(AGN-PC-0NXAXN)
Chemical Name	D-Phenylalanine, 3-fluoro-
IUPAC Name	(2R)-2-amino-3-(3-fluorophenyl)propanoic acid
InChI	InChI=1S/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
InChI Key	VWHRYODZTDMVSS-MRVPVSSYSA-N
MDL Number	MFCD00066449
Molecular Formula	C9H10FNO2
Molecular Weight	183.1796
SMILES	N[C@H](CC1=CC=CC(F)=C1)C(O)=O
Synonyms	3-Fluoro-D-phenylalanine, 110117-84-5, H-D-PHE(3-F)-OH, D-3-fluorophenylalanine, (2R)-2-amino-3-(3-fluorophenyl)propanoic acid, 3-FLUORO-D-PHE, D-3-FLUOROPHE, m-Fluoro-D-phenylalanine, (R)-2-AMINO-3-(3-FLUOROPHENYL)PROPANOIC ACID, MFCD00066449, 3-fluor-d-phenylalanin, PubChem17963, AC1LEQE9, AC1Q4NBJ, D-3-Fluoro phenylalanine, KSC497E4F, SCHEMBL288728, AMGLY00046, CTK3J7242, KS-00000ANH, KS-00000MLW, VWHRYODZTDMVSS-MRVPVSSYSA-N, ZINC113787, D-PHENYLALANINE, 3-FLUORO-, ANW-59160, CF-345, SBB063823, AB02698, AC-5828, AM83337, RTR-011953, AJ-11456, DS-13612, SC-10772, AB0012548, TL8000317, TR-011953, CS-0011436, FT-0642692, ST24042186, M-2551, (2R)-2-amino-3-(3-fluorophenyl)propionic acid, (2R)-2-azanyl-3-(3-fluorophenyl)propanoic acid, 117F845, m-Fluorophenylalanine, 3-Fluoro-L-phenylalanine, h-phe(3-f)-oh, D-3-F-PHE-OH, C9H10FNO2, DL-Phenylalanine, 3-fluoro-, DL-3-(3-Fluorophenyl)alanine, C9-H10-F-N-O2, EINECS 220-104-1, AR-1F3219, CID716317, NSC 41871, Alanine, 3-(m-fluorophenyl)-, DL-, ACN-026174, CB11582, (2S)-2-amino-3-(3-fluorophenyl)propanoic acid, 19883-77-3, 2629-54-1, 26423-78-9, 456-88-2,

Complexity	187
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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