Nonafluoro-1-butanesulfonyl chloride - CAS 2991-84-6

Catalog:	BB020383
Product Name:	Nonafluoro-1-butanesulfonyl chloride
CAS:	2991-84-6
Synonyms:	1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl chloride
Description:	Nonafluoro-1-butanesulfonyl chloride (CAS# 2991-84-6 ) is a useful research chemical.
Molecular Weight:	318.55
Molecular Formula:	C4ClF9O2S
Canonical SMILES:	C(C(C(F)(F)S(=O)(=O)Cl)(F)F)(C(F)(F)F)(F)F
InChI:	InChI=1S/C4ClF9O2S/c5-17(15,16)4(13,14)2(8,9)1(6,7)3(10,11)12
InChI Key:	IRFCLLARAUQTNK-UHFFFAOYSA-N
Boiling Point:	109.6 °C at 760 mmHg
Density:	1.807 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD03412262
LogP:	4.06150

Publication Number	Title	Priority Date
CN-112980457-A	Liquid crystal compound, liquid crystal composition, liquid crystal display element, or liquid crystal display	20191202
CN-110066378-A	Modified clothing leather polyurethane resin of fluorine-containing organic silicon and preparation method thereof	20190417
CN-110066378-B	Fluorine-containing organic silicon modified polyurethane resin for clothing leather and preparation method thereof	20190417
CN-110028693-A	A kind of preparation method of anti-odour absorption pipeline	20190415
WO-2020025591-A1	Inerting material surfaces by functionalized perfluorinated molecules	20180730

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Sulfur Compounds

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	390
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	317.9163816
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	11
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	317.9163816
Rotatable Bond Count:	3
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6