(E)-2,3-dichloroprop-2-ene-1-sulfonamide

C3H5Cl2NO2S — CID 139720182

IUPAC(E)-2,3-dichloroprop-2-ene-1-sulfonamide
SMILESNS(=O)(=O)C/C(Cl)=C\Cl
InChIInChI=1S/C3H5Cl2NO2S/c4-1-3(5)2-9(6,7)8/h1H,2H2,(H2,6,7,8)/b3-1+
InChIKeyKGBVIWBNSIOXMX-HNQUOIGGSA-N
MW190.05 g/mol
LogP0.59
Rot. Bonds2

About (E)-2,3-dichloroprop-2-ene-1-sulfonamide

(E)-2,3-dichloroprop-2-ene-1-sulfonamide (PubChem CID 139720182) has the molecular formula C3H5Cl2NO2S and a molecular weight of 190.05 g/mol. Its IUPAC name is (E)-2,3-dichloroprop-2-ene-1-sulfonamide.

Molecular Properties

Compound Name(E)-2,3-dichloroprop-2-ene-1-sulfonamide
PubChem CID139720182
Molecular FormulaC3H5Cl2NO2S
Molecular Weight190.05 g/mol
Exact Mass188.94
IUPAC Name(E)-2,3-dichloroprop-2-ene-1-sulfonamide
SMILESNS(=O)(=O)C/C(Cl)=C\Cl
InChIInChI=1S/C3H5Cl2NO2S/c4-1-3(5)2-9(6,7)8/h1H,2H2,(H2,6,7,8)/b3-1+
InChIKeyKGBVIWBNSIOXMX-HNQUOIGGSA-N
XLogP0.59
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.05
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dichloro-4-[(Z)-2,3-dichloroprop-2-enoxy]benzenesulfonamide
CID 82915373
5-bromo-3-(2,3-dichloroprop-2-enylsulfonyl)-2-fluorobenzoic acid
CID 79173266
2,3-dichloroprop-2-ene-1-sulfinate
CID 56998237
4-[(Z)-2,3-dichloroprop-2-enoxy]-2,3,5-trimethylbenzenesulfonamide
CID 82911867
1,2-dichloro-4-nitrosobut-1-ene
CID 173460621
ethyl (E)-3,4-dichlorobut-3-enoate
CID 165347749
(2E,4E)-4-amino-2-methylhexa-2,4-diene-1-sulfonamide
CID 163421018
N-(1,2-dichloroethenylsulfonyl)formamide
CID 56982242
lithium;2-chloroethenol;hydride
CID 173444450
chloromethane;prop-2-ene-1-sulfonamide
CID 174937700
ethyl 2-sulfamoylacetate;hydrochloride
CID 141070961
2-(2,3-dichloroprop-2-enylsulfanyl)acetic acid
CID 79168464

Frequently Asked Questions

What is the IUPAC name of (E)-2,3-dichloroprop-2-ene-1-sulfonamide?
The IUPAC name of (E)-2,3-dichloroprop-2-ene-1-sulfonamide (CID 139720182) is (E)-2,3-dichloroprop-2-ene-1-sulfonamide.
What is the SMILES notation for (E)-2,3-dichloroprop-2-ene-1-sulfonamide?
The canonical SMILES for (E)-2,3-dichloroprop-2-ene-1-sulfonamide is NS(=O)(=O)C/C(Cl)=C\Cl.
What is the InChIKey of (E)-2,3-dichloroprop-2-ene-1-sulfonamide?
The InChIKey is KGBVIWBNSIOXMX-HNQUOIGGSA-N. The full InChI is InChI=1S/C3H5Cl2NO2S/c4-1-3(5)2-9(6,7)8/h1H,2H2,(H2,6,7,8)/b3-1+.
What are the key properties of (E)-2,3-dichloroprop-2-ene-1-sulfonamide?
(E)-2,3-dichloroprop-2-ene-1-sulfonamide has a molecular weight of 190.05 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,3-dichloroprop-2-ene-1-sulfonamide is sourced from PubChem (CID 139720182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).