AG00GV85

873429-57-3 | 2,3-Dichloro-L-Phenylalanine

AG00GV85

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CAS Number	873429-57-3
Catalog Number	AG00GV85(AGN-PC-0OKYJB)
Chemical Name	2,3-Dichloro-L-Phenylalanine
IUPAC Name	(2S)-2-amino-3-(2,3-dichlorophenyl)propanoic acid
InChI	InChI=1S/C9H9Cl2NO2/c10-6-3-1-2-5(8(6)11)4-7(12)9(13)14/h1-3,7H,4,12H2,(H,13,14)/t7-/m0/s1
InChI Key	NVDAAIHKUHFKOL-ZETCQYMHSA-N
MDL Number	MFCD07372011
Molecular Formula	C9H9Cl2NO2
Molecular Weight	234.0793
SMILES	O=C(O)[C@@H](N)CC1=CC=CC(Cl)=C1Cl
Synonyms	873429-57-3, (S)-2-Amino-3-(2,3-dichlorophenyl)propanoic acid, 2,3-Dichloro-L-Phenylalanine, (2S)-2-AMINO-3-(2,3-DICHLOROPHENYL)PROPANOIC ACID, SCHEMBL17653888, DTXSID30654414, ZINC3679843, 3816AC, MFCD07372011, AKOS012010561, AB33512, DS-4992, AJ-45310, C9H9Cl2NO2, (S)-2-Amino-3-(2,3-dichlorophenyl)propanoicacid,

Complexity	213
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	233.001g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	234.076g/mol
Monoisotopic Mass	233.001g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

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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