AG003LFX

42908-73-6 | 4-Fluorophenyl Chlorothionoformate

AG003LFX

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CAS Number	42908-73-6
Catalog Number	AG003LFX(AGN-PC-0LLO6O)
Chemical Name	4-Fluorophenyl Chlorothionoformate
IUPAC Name	O-(4-fluorophenyl) chloromethanethioate
InChI	InChI=1S/C7H4ClFOS/c8-7(11)10-6-3-1-5(9)2-4-6/h1-4H
InChI Key	HZBXSUFBKXPOAF-UHFFFAOYSA-N
MDL Number	MFCD00134402
Molecular Formula	C7H4ClFOS
Molecular Weight	190.6225
SMILES	S=C(Cl)OC1=CC=C(F)C=C1
Synonyms	42908-73-6, 4-Fluorophenyl chlorothionoformate, O-(4-fluorophenyl) carbonochloridothioate, Chlorothioformic Acid O-(4-Fluorophenyl) Ester, 4-fluorophenyl chlorothioformate, Carbonochloridothioic acid, O-(4-fluorophenyl) ester, O-4-fluorophenyl carbonochloridothioate, AC1NNJN2, SCHEMBL742569, CTK1D5699, DTXSID40407756, HZBXSUFBKXPOAF-UHFFFAOYSA-N, ZINC389825, ANW-42309, MFCD00134402, O-(4-Fluorophenyl) Chlorothioformate, AKOS000216109, O-(4-fluorophenyl) chloromethanethioate, ZB011888, RT-003969, F0365, FT-0639813, I09-3281, (4-fluorophenoxy)methanethioyl Chloride, CID5045332,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.966g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	190.616g/mol
Monoisotopic Mass	189.966g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	41.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H314
Packing Group
Precautionary statements	P210-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405-P501
UN Code	\N

Certificate of Analysis

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