AG0009DF

1137014-87-9 | 2-Amino-(3,5-dichloro-phenyl)-acetic acid, HCl

AG0009DF

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CAS Number	1137014-87-9
Catalog Number	AG0009DF(AGN-PC-04Q6OC)
Chemical Name	2-Amino-(3,5-dichloro-phenyl)-acetic acid, HCl
IUPAC Name	2-amino-2-(3,5-dichlorophenyl)acetic acid;hydrochloride
InChI	InChI=1S/C8H7Cl2NO2.ClH/c9-5-1-4(2-6(10)3-5)7(11)8(12)13;/h1-3,7H,11H2,(H,12,13);1H
InChI Key	CPQMVIKDRJMUKS-UHFFFAOYSA-N
MDL Number	MFCD06202321
Molecular Formula	C8H8Cl3NO2
Molecular Weight	256.5136
SMILES	O=C(O)C(N)C1=CC(Cl)=CC(Cl)=C1.[H]Cl
Synonyms	1137014-87-9, 2-AMINO-2-(3,5-DICHLOROPHENYL)ACETIC ACID HYDROCHLORIDE, 2-AMINO-2-(3,5-DICHLOROPHENYL)ACETIC ACID HCL, 5416AJ, MFCD06202321, AKOS022183952, AB23118, AK-83930, DS-17341, SY015084, AX8280754, TC-306975, FT-0722688, MFCD06202321 (95%), 2-Amino-(3,5-dichloro-phenyl)-acetic acid, HCl, Benzeneacetic acid, alpha-amino-3,5-dichloro-, hydrochloride (1:1), C8H7Cl2NO2.HCl, 837430-14-5,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.962g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	256.507g/mol
Monoisotopic Mass	254.962g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	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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