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3-(Dimethylamino)propane-1-sulfonyl Chloride Hydrochloride

3-(Dimethylamino)propane-1-sulfonyl Chloride Hydrochloride - CAS 118646-42-7

Catalog:	BB004195
Product Name:	3-(Dimethylamino)propane-1-sulfonyl Chloride Hydrochloride
CAS:	118646-42-7
Synonyms:	3-(dimethylamino)-1-propanesulfonyl chloride;hydrochloride; 3-(dimethylamino)propane-1-sulfonyl chloride;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(dimethylamino)propane-1-sulfonyl chloride;hydrochloride
Description:	3-(Dimethylamino)propane-1-sulfonyl Chloride Hydrochloride (CAS# 118646-42-7 ) is a useful research chemical.
Molecular Weight:	222.13
Molecular Formula:	C5H13Cl2NO2S
Canonical SMILES:	CN(C)CCCS(=O)(=O)Cl.Cl
InChI:	InChI=1S/C5H12ClNO2S.ClH/c1-7(2)4-3-5-10(6,8)9;/h3-5H2,1-2H3;1H
InChI Key:	BYKKHSIDBWTCTP-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	2.38950

Publication Number	Title	Priority Date
WO-2019185631-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo [2, 3-b] pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-B2	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
CA-3085967-A1	4-(1h-imidazol-5-yl)-1h-pyrrolo[2,3-b]pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
CN-111936496-A	Use of 4- (1H-imidazol-5-yl) -1H-pyrrolo [2,3-B ] pyridine for the treatment of leukemias, lymphomas and solid tumors	20180329

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Related Functional Groups

Sulfur Compounds

[123-43-3]
Sulfoacetic acid
[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
[52147-97-4]
trans-β-Styrenesulfonyl chloride

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.0044052
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	221.0044052
Rotatable Bond Count:	4
Topological Polar Surface Area:	45.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0