(1Z)-5-chlorocyclododecene

C12H21Cl — CID 70120739

IUPAC(1Z)-5-chlorocyclododecene
SMILESClC1CC/C=C\CCCCCCC1
InChIInChI=1S/C12H21Cl/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h4,6,12H,1-3,5,7-11H2/b6-4-
InChIKeySVTBJJRNHCIWSN-XQRVVYSFSA-N
MW200.75 g/mol
LogP4.67
Rot. Bonds

About (1Z)-5-chlorocyclododecene

(1Z)-5-chlorocyclododecene (PubChem CID 70120739) has the molecular formula C12H21Cl and a molecular weight of 200.75 g/mol. Its IUPAC name is (1Z)-5-chlorocyclododecene.

Molecular Properties

Compound Name(1Z)-5-chlorocyclododecene
PubChem CID70120739
Molecular FormulaC12H21Cl
Molecular Weight200.75 g/mol
Exact Mass200.13
IUPAC Name(1Z)-5-chlorocyclododecene
SMILESClC1CC/C=C\CCCCCCC1
InChIInChI=1S/C12H21Cl/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h4,6,12H,1-3,5,7-11H2/b6-4-
InChIKeySVTBJJRNHCIWSN-XQRVVYSFSA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.75
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1Z)-6-chlorocyclopentadecene
CID 138480861
cyclododecene;cyclohexylcyclohexane
CID 173310836
chlorocyclohexane;silane
CID 162121127
cyclopentadecene
CID 5463009
(1E)-cyclooctadeca-1,8-diene
CID 173129359
(1E,8E)-cyclotetradeca-1,8-diene
CID 638080
(1Z,9E,17E)-cyclotetracosa-1,9,17-triene
CID 153422638
cyclopentadeca-1,7-diene
CID 154173092
(1Z,9E)-cyclooctadeca-1,9-diene
CID 143896650
(7Z)-cyclohexadeca-1,7-diene
CID 173129118
(1Z)-5-methylcycloundecene
CID 22177383
cyclohexene;cyclohexyloxycyclohexane
CID 174935806

Frequently Asked Questions

What is the IUPAC name of (1Z)-5-chlorocyclododecene?
The IUPAC name of (1Z)-5-chlorocyclododecene (CID 70120739) is (1Z)-5-chlorocyclododecene.
What is the SMILES notation for (1Z)-5-chlorocyclododecene?
The canonical SMILES for (1Z)-5-chlorocyclododecene is ClC1CC/C=C\CCCCCCC1.
What is the InChIKey of (1Z)-5-chlorocyclododecene?
The InChIKey is SVTBJJRNHCIWSN-XQRVVYSFSA-N. The full InChI is InChI=1S/C12H21Cl/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h4,6,12H,1-3,5,7-11H2/b6-4-.
What are the key properties of (1Z)-5-chlorocyclododecene?
(1Z)-5-chlorocyclododecene has a molecular weight of 200.75 g/mol, XLogP of 4.67, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-5-chlorocyclododecene is sourced from PubChem (CID 70120739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).