2-chloroprop-2-enylidenecyclohexane

C9H13Cl — CID 10964768

IUPAC2-chloroprop-2-enylidenecyclohexane
SMILESC=C(Cl)C=C1CCCCC1
InChIInChI=1S/C9H13Cl/c1-8(10)7-9-5-3-2-4-6-9/h7H,1-6H2
InChIKeyRZPHHAHHYZKBKC-UHFFFAOYSA-N
MW156.66 g/mol
LogP3.63
Rot. Bonds1

About 2-chloroprop-2-enylidenecyclohexane

2-chloroprop-2-enylidenecyclohexane (PubChem CID 10964768) has the molecular formula C9H13Cl and a molecular weight of 156.66 g/mol. Its IUPAC name is 2-chloroprop-2-enylidenecyclohexane.

Molecular Properties

Compound Name2-chloroprop-2-enylidenecyclohexane
PubChem CID10964768
Molecular FormulaC9H13Cl
Molecular Weight156.66 g/mol
Exact Mass156.07
IUPAC Name2-chloroprop-2-enylidenecyclohexane
SMILESC=C(Cl)C=C1CCCCC1
InChIInChI=1S/C9H13Cl/c1-8(10)7-9-5-3-2-4-6-9/h7H,1-6H2
InChIKeyRZPHHAHHYZKBKC-UHFFFAOYSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.66
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-chloroprop-2-enylidenecyclohexane?
The IUPAC name of 2-chloroprop-2-enylidenecyclohexane (CID 10964768) is 2-chloroprop-2-enylidenecyclohexane.
What is the SMILES notation for 2-chloroprop-2-enylidenecyclohexane?
The canonical SMILES for 2-chloroprop-2-enylidenecyclohexane is C=C(Cl)C=C1CCCCC1.
What is the InChIKey of 2-chloroprop-2-enylidenecyclohexane?
The InChIKey is RZPHHAHHYZKBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13Cl/c1-8(10)7-9-5-3-2-4-6-9/h7H,1-6H2.
What are the key properties of 2-chloroprop-2-enylidenecyclohexane?
2-chloroprop-2-enylidenecyclohexane has a molecular weight of 156.66 g/mol, XLogP of 3.63, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloroprop-2-enylidenecyclohexane is sourced from PubChem (CID 10964768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).