AG00IE4K

865664-05-7 | 2'-Fluoro-3'-methylacetophenone

AG00IE4K

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CAS Number	865664-05-7
Catalog Number	AG00IE4K(AGN-PC-0WAKRZ)
Chemical Name	2'-Fluoro-3'-methylacetophenone
IUPAC Name	1-(2-fluoro-3-methylphenyl)ethanone
InChI	InChI=1S/C9H9FO/c1-6-4-3-5-8(7(2)11)9(6)10/h3-5H,1-2H3
InChI Key	RVKFUFWKGZPWBR-UHFFFAOYSA-N
MDL Number	MFCD13194343
Molecular Formula	C9H9FO
Molecular Weight	152.1656
SMILES	CC(C1=CC=CC(C)=C1F)=O
Synonyms	865664-05-7, 1-(2-fluoro-3-methylphenyl)ethanone, 2'-Fluoro-3'-methylacetophenone, 1-(2-fluoro-3-methylphenyl)ethan-1-one, SCHEMBL1642296, RVKFUFWKGZPWBR-UHFFFAOYSA-N, MFCD13194343, ZINC59873268, AKOS017515592, AK327202, DS-11947,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.064g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	152.168g/mol
Monoisotopic Mass	152.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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