N-tert-butylsulfamoyl Chloride - CAS 33581-95-2

Catalog:	BB021787
Product Name:	N-tert-butylsulfamoyl Chloride
CAS:	33581-95-2
Synonyms:	N-tert-butylsulfamoyl chloride; N-tert-butylsulfamoyl chloride

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Computed Properties

IUPAC Name:	N-tert-butylsulfamoyl chloride
Description:	N-tert-butylsulfamoyl Chloride (CAS# 33581-95-2) is a useful research chemical.
Molecular Weight:	171.65
Molecular Formula:	C4H10ClNO2S
Canonical SMILES:	CC(C)(C)NS(=O)(=O)Cl
InChI:	InChI=1S/C4H10ClNO2S/c1-4(2,3)6-9(5,7)8/h6H,1-3H3
InChI Key:	WGBSTIRRHNSMRN-UHFFFAOYSA-N
LogP:	2.32980

Publication Number	Title	Priority Date
WO-2021050992-A1	Usp30 inhibitors and uses thereof	20190911
AU-2016291676-A1	Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors	20150716
AU-2016291676-B2	Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors	20150716
CA-2992586-A1	Substituted pyrazolo[1,5-a]pyridine compounds as ret kinase inhibitors	20150716
EA-035049-B1	COMPOUNDS OF SUBSTITUTED PYRAZOLO [1,5-a] PYRIDINE AS RET KINASE INHIBITORS	20150716

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Related Functional Groups

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	174
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.0120774
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.0120774
Rotatable Bond Count:	2
Topological Polar Surface Area:	54.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1