(1Z)-1,2-dibutylcyclodecene

C18H34 — CID 24974253

IUPAC(1Z)-1,2-dibutylcyclodecene
SMILESCCCC/C1=C(\CCCC)CCCCCCCC1
InChIInChI=1S/C18H34/c1-3-5-13-17-15-11-9-7-8-10-12-16-18(17)14-6-4-2/h3-16H2,1-2H3/b18-17-
InChIKeyQQXLQUSSQHBORH-ZCXUNETKSA-N
MW250.47 g/mol
LogP6.80
Rot. Bonds6

About (1Z)-1,2-dibutylcyclodecene

(1Z)-1,2-dibutylcyclodecene (PubChem CID 24974253) has the molecular formula C18H34 and a molecular weight of 250.47 g/mol. Its IUPAC name is (1Z)-1,2-dibutylcyclodecene.

Molecular Properties

Compound Name(1Z)-1,2-dibutylcyclodecene
PubChem CID24974253
Molecular FormulaC18H34
Molecular Weight250.47 g/mol
Exact Mass250.27
IUPAC Name(1Z)-1,2-dibutylcyclodecene
SMILESCCCC/C1=C(\CCCC)CCCCCCCC1
InChIInChI=1S/C18H34/c1-3-5-13-17-15-11-9-7-8-10-12-16-18(17)14-6-4-2/h3-16H2,1-2H3/b18-17-
InChIKeyQQXLQUSSQHBORH-ZCXUNETKSA-N
XLogP6.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.47
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Cyclohexene, 1-ethyl-2-methyl-
CID 88242
8-Heptadecene, 9-octyl-
CID 292287
2-Octene, 2,3-dimethyl-
CID 140599
Cycloheptene, 1,2-dimethyl-
CID 519742
Bicyclo[7.7.0]hexadec-1(9)-ene
CID 534882
5,6-Dibutyl-dec-5-ene
CID 11807167
(E)-9-methyloctadec-9-ene
CID 14825491
9-Methyloctadec-9-ene
CID 54259429
4-Methyloctadec-3-ene
CID 71362601
3-Ethyl-2-methyloct-2-ene
CID 85682407
1,2-Dioctylcyclopropene
CID 556893
Cyclooctene, 1,2-dimethyl-
CID 5362808

Frequently Asked Questions

What is the IUPAC name of (1Z)-1,2-dibutylcyclodecene?
The IUPAC name of (1Z)-1,2-dibutylcyclodecene (CID 24974253) is (1Z)-1,2-dibutylcyclodecene.
What is the SMILES notation for (1Z)-1,2-dibutylcyclodecene?
The canonical SMILES for (1Z)-1,2-dibutylcyclodecene is CCCC/C1=C(\CCCC)CCCCCCCC1.
What is the InChIKey of (1Z)-1,2-dibutylcyclodecene?
The InChIKey is QQXLQUSSQHBORH-ZCXUNETKSA-N. The full InChI is InChI=1S/C18H34/c1-3-5-13-17-15-11-9-7-8-10-12-16-18(17)14-6-4-2/h3-16H2,1-2H3/b18-17-.
What are the key properties of (1Z)-1,2-dibutylcyclodecene?
(1Z)-1,2-dibutylcyclodecene has a molecular weight of 250.47 g/mol, XLogP of 6.80, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1,2-dibutylcyclodecene is sourced from PubChem (CID 24974253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).