AG001X5C

16712-69-9 | Benzenesulfonyl chloride, 4-ethyl-

AG001X5C

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CAS Number	16712-69-9
Catalog Number	AG001X5C(AGN-PC-0JT2RS)
Chemical Name	Benzenesulfonyl chloride, 4-ethyl-
IUPAC Name	4-ethylbenzenesulfonyl chloride
InChI	InChI=1S/C8H9ClO2S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3
InChI Key	LACFLXDRFOQEFZ-UHFFFAOYSA-N
MDL Number	MFCD00041480
Molecular Formula	C8H9ClO2S
Molecular Weight	204.6739
SMILES	CCC1=CC=C(C=C1)S(Cl)(=O)=O
Synonyms	4-Ethylbenzenesulfonyl chloride, 16712-69-9, 4-ethylbenzene-1-sulfonyl chloride, 4-Ethylbenzenesulphonyl chloride, P-ETHYLBENZENESULFONYL CHLORIDE, 4-Ethyl-benzenesulfonyl chloride, MFCD00041480, Ethylbenzenesulfonylchloride, 4-ethylbenzenesulfonylchloride, LACFLXDRFOQEFZ-UHFFFAOYSA-N, chloro(4-ethylphenyl)sulfone, PubChem5133, ACMC-209dvn, AC1LC7PD, AC1Q2TIK, AC1Q2TIL, AC1Q3VNQ, 4-ethylphenylsulfonyl chloride, SCHEMBL344067, ZERENEX ZX009560, 4-ethyl benzenesulfonyl chloride, 4-ethylben-zenesulfonyl chloride, CTK0H4389, DTXSID10341198, LABOTEST-BB LTBB004511, Benzenesulfonyl chloride, 4-ethyl-, ALBB-000976, ANW-22257, BBL013799, LABOTEST-BB LT03381729, SBB058889, STK500494, ZINC59796719, 4-EthYl-Benzene-1-Sulfonyl Chloride, AKOS000200511, AS03395, MCULE-2249432795, RP04493, VZ33560, KS-000013B8, OTAVA-BB 7020694366, AS-45914, SC-01583, AB0040188, TR-007236, E0065, FT-0618403, ST24029079, ST50411828, Y7764, EN300-21617, L-2604, 37362-EP2311802A1, 37362-EP2311803A1, I01-3269, J-515295, F0808-2052, 4-ethylbenzenesulfonyl, C8H9ClO2S, 4-Ethyl-Benzenesulfonylchloride, 3-Amino-1,2,4-triazole-5-thiol, AR-1G2251, CID570959, 5-Amino-4H-1,2,4-Triazole-3-Thiol, 4-ETHYL BENZENE SULPHONYL CHLORIDE, 16781-39-8,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.001g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	204.668g/mol
Monoisotopic Mass	204.001g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	4.2
Hazard statements	H228-H251-H302-H312-H314-H318-H332
Packing Group	Ⅱ
Precautionary statements	P210-P260h-P303+P361+P353-P305+P351+P338-P405-P501a
Signal Words	danger
UN Code	UN 2318

Certificate of Analysis

Lot Number