AG00C1TW

252873-46-4 | 3-Phenoxy-benzenesulfonyl chloride

AG00C1TW

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CAS Number	252873-46-4
Catalog Number	AG00C1TW(AGN-PC-0KKNVP)
Chemical Name	3-Phenoxy-benzenesulfonyl chloride
IUPAC Name	3-phenoxybenzenesulfonyl chloride
InChI	InChI=1S/C12H9ClO3S/c13-17(14,15)12-8-4-7-11(9-12)16-10-5-2-1-3-6-10/h1-9H
InChI Key	JXJUPXKGJUPDHK-UHFFFAOYSA-N
MDL Number	MFCD02089483
Molecular Formula	C12H9ClO3S
Molecular Weight	268.7161
SMILES	ClS(=O)(=O)c1cccc(c1)Oc1ccccc1
Synonyms	3-phenoxybenzenesulfonyl Chloride, 252873-46-4, 3-Phenoxy-benzenesulfonyl chloride, 3-phenoxybenzene-1-sulfonyl chloride, [(3-phenoxy)benzene]sulphonyl chloride, [(3-phenoxy)benzene]sulfonyl chloride, Benzenesulfonylchloride, 3-phenoxy-, AC1MC2GG, SCHEMBL2837656, m-Phenoxybenzenesulfonyl chloride, CTK1A0443, DTXSID10375115, 3-(Chlorosulphonyl)diphenyl ether, 3PBS-0-0, [(3-phenoxy)benzene]sulfonylchloride, 5372AH, AR1604, MFCD02089483, STL302099, ZINC95697013, (TRIFLUORO-M-TOLYL)ACETIC ACID, AKOS015958671, MCULE-1917450068, AK188873, AS-45167, BC685421, AB0086493, A-7174, F9995-1745, C12H9ClO3S, CID2760338,

Complexity	330
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.996g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	268.711g/mol
Monoisotopic Mass	267.996g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
Signal Words	danger
UN Code	UN 1759

Certificate of Analysis

Lot Number