AG003MR6

21900-39-0 | 5-Fluoro-2-methylbenzoyl chloride

AG003MR6

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CAS Number	21900-39-0
Catalog Number	AG003MR6(AGN-PC-0KK8HI)
Chemical Name	5-Fluoro-2-methylbenzoyl chloride
IUPAC Name	5-fluoro-2-methylbenzoyl chloride
InChI	InChI=1S/C8H6ClFO/c1-5-2-3-6(10)4-7(5)8(9)11/h2-4H,1H3
InChI Key	HBAQRSDZSVESSF-UHFFFAOYSA-N
MDL Number	MFCD00236681
Molecular Formula	C8H6ClFO
Molecular Weight	172.5840
SMILES	O=C(Cl)C1=CC(F)=CC=C1C
Synonyms	5-Fluoro-2-methylbenzoyl chloride, 21900-39-0, 5-fluoro-2-methylbenzoylchloride, 5-Fluoro-2-Methyl-Benzoyl Chloride, 5-Fluoro-o-toluoyl chloride, Benzoyl chloride,5-fluoro-2-methyl-, MFCD00236681, ACMC-1CIAQ, AC1Q2EFE, AC1MC786, SCHEMBL1364589, CTK4E7925, DTXSID70372029, 2-methyl-5-fluorobenzoyl chloride, HBAQRSDZSVESSF-UHFFFAOYSA-N, 5-Fluoro-2-methyl benzoylchloride, 5-Fluoro-2-methyl benzoyl chloride, JRD-0849, ZINC2560325, 5-fluoro-2-methyl -benzoyl chloride, SBB088706, AKOS009157675, Benzoyl chloride, 5-fluoro-2-methyl-, AM61397, VZ30329, 5-Fluoro-2-methylbenzoyl chloride, 97%, AS-47811, DB-045724, TR-010268, FT-0620401, Y-8924, J-014337, I01-15286, ZINC02560325, CID2737383,

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	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
UN Code	UN 3265

Certificate of Analysis

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