AG003JHE

7423-96-3 | (S)-2-Amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid

AG003JHE

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CAS Number	7423-96-3
Catalog Number	AG003JHE(AGN-PC-0WAKAC)
Chemical Name	(S)-2-Amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid
IUPAC Name	(2S)-2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid
InChI	InChI=1S/C9H10FNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1
InChI Key	VIIAUOZUUGXERI-ZETCQYMHSA-N
MDL Number	MFCD00002607
Molecular Formula	C9H10FNO3
Molecular Weight	199.1790
SMILES	O=C(O)[C@@H](N)CC1=CC=C(O)C(F)=C1
UNII	174NRG3M2X
Synonyms	3-fluoro-tyrosine, 3-fluorotyrosine, 3-fluorotyrosine, (D)-isomer, 3-fluorotyrosine, (DL)-isomer, meta-fluorotyrosine, 3-fluoro-L-tyrosine, 7423-96-3, (s)-2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid, 3-Fluorotyrosine, h-tyr(3-f)-oh, 3-Fluorotyrosine, L-, UNII-174NRG3M2X, (s)-3-fluorotyrosine, 3'-fluoro-l-tyrosine, (S)-3-Fluorotyrsine, 174NRG3M2X, CHEBI:46534, MFCD00002607, 139-26-4, (2S)-2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid, 3-fluoro-tyrosine, L-m-Fluorotyrosine, L-Tyrosine, 3-fluoro-, Tyrosine, 3-fluoro-, L-, s-3-fluorotyrosine, PubChem13968, AC1LD6ZK, Tyr(3-F)-OH, SCHEMBL274651, CHEMBL1236909, CTK0H8066, (s)-2-amino-3-(3-fluoro-4-hydroxy-phenyl)-propionic acid, DTXSID10225227, VIIAUOZUUGXERI-ZETCQYMHSA-N, ZINC119457, 3-fluoro-4-hydroxy-l-phenylalanine, ACT05083, KS-000013BM, ANW-36451, AKOS005258348, AKOS006239313, AM83571, DB04436, AJ-11585, DS-18133, SC-11017, TR-023994, F0201, FT-0615735, W8200, X-3539, 423T963, I14-29736, UNII-084C55865H component VIIAUOZUUGXERI-ZETCQYMHSA-N, YOF, 3-Fluorotyrosin, Tyrosine, 3-fluoro-, C9H10FNO3, (5-fluoropyridin-3-yl)methanol, CID643330, 403-90-7,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	199.064g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	199.181g/mol
Monoisotopic Mass	199.064g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	83.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number