1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride

C7H9ClF2O2S — CID 165489934

IUPAC1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride
SMILESO=S(=O)(Cl)C1(CC2CC2(F)F)CC1
InChIInChI=1S/C7H9ClF2O2S/c8-13(11,12)6(1-2-6)3-5-4-7(5,9)10/h5H,1-4H2
InChIKeyGYUGXWCIGFVKHW-UHFFFAOYSA-N
MW230.66 g/mol
LogP2.13
Rot. Bonds3

About 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride

1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride (PubChem CID 165489934) has the molecular formula C7H9ClF2O2S and a molecular weight of 230.66 g/mol. Its IUPAC name is 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride.

Molecular Properties

Compound Name1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride
PubChem CID165489934
Molecular FormulaC7H9ClF2O2S
Molecular Weight230.66 g/mol
Exact Mass230.00
IUPAC Name1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride
SMILESO=S(=O)(Cl)C1(CC2CC2(F)F)CC1
InChIInChI=1S/C7H9ClF2O2S/c8-13(11,12)6(1-2-6)3-5-4-7(5,9)10/h5H,1-4H2
InChIKeyGYUGXWCIGFVKHW-UHFFFAOYSA-N
XLogP2.13
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.66
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Cyclopropyl-2,2-difluoropropane-1-sulfonyl chloride
CID 105473382
(R)-1-(2,3-Difluoropropyl)cyclopropane-1-sulfonyl chloride
CID 55279586
1-(2,3-Difluoropropyl)cyclopropane-1-sulfonyl chloride
CID 76223091
3-Cyclopropyl-3,3-difluoropropane-1-sulfonyl chloride
CID 105473383
1-(4,4-Difluorobutyl)cyclopropane-1-sulfonyl chloride
CID 165489935
1-(3,3,3-Trifluoropropyl)cyclopropane-1-sulfonyl chloride
CID 165490510
1-[2-(2,2-Difluorocyclopropyl)ethyl]cyclopropane-1-sulfonyl chloride
CID 165495030
1-(2-Ethyl-4,4-difluorobutyl)cyclopropane-1-sulfonyl chloride
CID 165495032
1-(2,2-Difluoropropyl)cyclopropane-1-sulfonyl chloride
CID 165495065
1-(2-Ethyl-4,4,4-trifluorobutyl)cyclopropane-1-sulfonyl chloride
CID 165495702
1-(4,4-Difluoro-2-methylbutyl)cyclopropane-1-sulfonyl chloride
CID 165742148
1-(2,2-Difluorobutyl)cyclopropane-1-sulfonyl chloride
CID 165742149

Frequently Asked Questions

What is the IUPAC name of 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride?
The IUPAC name of 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride (CID 165489934) is 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride.
What is the SMILES notation for 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride?
The canonical SMILES for 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride is O=S(=O)(Cl)C1(CC2CC2(F)F)CC1.
What is the InChIKey of 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride?
The InChIKey is GYUGXWCIGFVKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClF2O2S/c8-13(11,12)6(1-2-6)3-5-4-7(5,9)10/h5H,1-4H2.
What are the key properties of 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride?
1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride has a molecular weight of 230.66 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,2-difluorocyclopropyl)methyl]cyclopropane-1-sulfonyl chloride is sourced from PubChem (CID 165489934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).