AG00337T

700-35-6 | 1-(2-Chloro-4-fluorophenyl)ethanone

AG00337T

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CAS Number	700-35-6
Catalog Number	AG00337T(AGN-PC-0KK7VJ)
Chemical Name	1-(2-Chloro-4-fluorophenyl)ethanone
IUPAC Name	1-(2-chloro-4-fluorophenyl)ethanone
InChI	InChI=1S/C8H6ClFO/c1-5(11)7-3-2-6(10)4-8(7)9/h2-4H,1H3
InChI Key	CSEMGLVHVZRXQF-UHFFFAOYSA-N
MDL Number	MFCD00042202
Molecular Formula	C8H6ClFO
Molecular Weight	172.5840
SMILES	ClC1=C(C=CC(=C1)F)C(C)=O
Synonyms	700-35-6, 1-(2-chloro-4-fluorophenyl)ethanone, 2'-CHLORO-4'-FLUOROACETOPHENONE, 2-chloro-4-fluoroacetophenone, Ethanone, 1-(2-chloro-4-fluorophenyl)-, 1-(2-Chloro-4-fluorophenyl)ethan-1-one, MFCD00042202, 1-acetyl-2-chloro-4-fluorobenzene, PubChem4187, AC1MC5QR, AC1Q1JFJ, 2-chloro-4-fluoracetophenone, KSC631O2L, SCHEMBL473969, 4'-fluoro-2'-chloroacetophenone, CTK5D1725, DTXSID70371411, CSEMGLVHVZRXQF-UHFFFAOYSA-N, ACT00266, KS-00000MY0, ZINC2584275, 2'-Chloro-4'-fluoroacetophenone99, 2\'-Chloro-4\'-fluoroacetophenone, ANW-47055, SBB064482, AKOS001160394, AM62518, AS04025, CM11158, CS-W008455, DS-1752, MCULE-1036916152, PS-8657, RP23496, TRA0069694, VZ21843, Ethanone,1-(2-chloro-4-fluorophenyl)-, AJ-43377, AK-53695, BR-53695, CJ-10341, EN001539, SC-06383, SY047832, AB0018058, DB-020813, ST2414942, TC-135800, FT-0611756, ST50408498, EN300-14853, MFCD00042202 (97%), 1-(2-CHLORO-4-FLUORO-PHENYL)-ETHANONE, A19698, M-2762, I01-4949, J-508734, 2 inverted exclamation mark -Chloro-4 inverted exclamation mark -fluoroacetophenone, C8H6ClFO, ZINC02584275, ACN-055728, CID2736507, R220, 2'-Chloro-4'-fluoroacetophenone, 98% 1g, C2643, 456-04-2,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.009g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.583g/mol
Monoisotopic Mass	172.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number