AG00BE14

299166-66-8 | AMINO-(3-FLUORO-4-METHOXY-PHENYL)-ACETIC ACID

AG00BE14

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CAS Number	299166-66-8
Catalog Number	AG00BE14(AGN-PC-0R5BUQ)
Chemical Name	AMINO-(3-FLUORO-4-METHOXY-PHENYL)-ACETIC ACID
IUPAC Name	2-amino-2-(3-fluoro-4-methoxyphenyl)acetic acid
InChI	InChI=1S/C9H10FNO3/c1-14-7-3-2-5(4-6(7)10)8(11)9(12)13/h2-4,8H,11H2,1H3,(H,12,13)
InChI Key	BPKLMQYFJHGPQW-UHFFFAOYSA-N
MDL Number	MFCD02662432
Molecular Formula	C9H10FNO3
Molecular Weight	199.1790
SMILES	COC1=C(F)C=C(C(C(O)=O)N)C=C1
Synonyms	299166-66-8, 2-amino-2-(3-fluoro-4-methoxyphenyl)acetic acid, AMINO-(3-FLUORO-4-METHOXY-PHENYL)-ACETIC ACID, 2-(3-Fluoro-4-methoxyphenyl)-DL-glycine, AC1MZY3O, SCHEMBL3817028, CTK4G4054, DTXSID10398021, BPKLMQYFJHGPQW-UHFFFAOYSA-N, MFCD02662432, AKOS006278296, MCULE-9283439393, NE47129, SC-59494, SY154234, Amino(3-fluoro-4-methoxyphenyl)acetic acid, ST2404095, MFCD02662432 (97%), Benzeneacetic acid, alpha-amino-3-fluoro-4-methoxy-, Z1723549311, AMINO- -ACETICACID, CID3929110, 2-amino-2-(3-fluoro-4-methoxy-phenyl)acetic Acid,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
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	2
Isotope Atom Count	0
Molecular Weight	199.181g/mol
Monoisotopic Mass	199.064g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	72.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H318
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 1759

Certificate of Analysis

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