(2-cyclohexyl-1,1-dimethoxydecyl)benzene

C24H40O2 — CID 150097969

IUPAC(2-cyclohexyl-1,1-dimethoxydecyl)benzene
SMILESCCCCCCCCC(C1CCCCC1)C(OC)(OC)c1ccccc1
InChIInChI=1S/C24H40O2/c1-4-5-6-7-8-15-20-23(21-16-11-9-12-17-21)24(25-2,26-3)22-18-13-10-14-19-22/h10,13-14,18-19,21,23H,4-9,11-12,15-17,20H2,1-3H3
InChIKeyDUQGEZARZYDOTP-UHFFFAOYSA-N
MW360.58 g/mol
LogP7.08
Rot. Bonds12

About (2-cyclohexyl-1,1-dimethoxydecyl)benzene

(2-cyclohexyl-1,1-dimethoxydecyl)benzene (PubChem CID 150097969) has the molecular formula C24H40O2 and a molecular weight of 360.58 g/mol. Its IUPAC name is (2-cyclohexyl-1,1-dimethoxydecyl)benzene.

Molecular Properties

Compound Name(2-cyclohexyl-1,1-dimethoxydecyl)benzene
PubChem CID150097969
Molecular FormulaC24H40O2
Molecular Weight360.58 g/mol
Exact Mass360.30
IUPAC Name(2-cyclohexyl-1,1-dimethoxydecyl)benzene
SMILESCCCCCCCCC(C1CCCCC1)C(OC)(OC)c1ccccc1
InChIInChI=1S/C24H40O2/c1-4-5-6-7-8-15-20-23(21-16-11-9-12-17-21)24(25-2,26-3)22-18-13-10-14-19-22/h10,13-14,18-19,21,23H,4-9,11-12,15-17,20H2,1-3H3
InChIKeyDUQGEZARZYDOTP-UHFFFAOYSA-N
XLogP7.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.58
LogP ≤ 57.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze (2-cyclohexyl-1,1-dimethoxydecyl)benzene 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

(1,1-dimethoxy-2-octyldodecyl)benzene
CID 150569123
(1,1-dimethoxy-2-octylundecyl)benzene
CID 151680252
(2-chloro-2-methylnonadecan-3-yl)cyclohexane
CID 70371697
(1-cyclooctyl-1,1-dipropoxydecan-2-yl)cyclooctane
CID 152602584
(1-methoxy-2-methyl-1-phenyldecyl)benzene
CID 158531120
1,1,2-tricyclohexyldodecylphosphane
CID 67839264
(2-tert-butyl-1-methoxy-1-phenyldecyl)benzene
CID 151749731
(1-cyclopropyl-1,1-dimethoxydecan-2-yl)cyclopropane
CID 151507432
1-cyclohexylheptylcyclohexane
CID 16404
1-cycloheptyldecylcycloheptane
CID 20559033
hexadecan-8-ylcyclohexane
CID 91510029
1,1,1-tripropoxydecan-2-ylcyclopropane
CID 151363480

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexyl-1,1-dimethoxydecyl)benzene?
The IUPAC name of (2-cyclohexyl-1,1-dimethoxydecyl)benzene (CID 150097969) is (2-cyclohexyl-1,1-dimethoxydecyl)benzene.
What is the SMILES notation for (2-cyclohexyl-1,1-dimethoxydecyl)benzene?
The canonical SMILES for (2-cyclohexyl-1,1-dimethoxydecyl)benzene is CCCCCCCCC(C1CCCCC1)C(OC)(OC)c1ccccc1.
What is the InChIKey of (2-cyclohexyl-1,1-dimethoxydecyl)benzene?
The InChIKey is DUQGEZARZYDOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40O2/c1-4-5-6-7-8-15-20-23(21-16-11-9-12-17-21)24(25-2,26-3)22-18-13-10-14-19-22/h10,13-14,18-19,21,23H,4-9,11-12,15-17,20H2,1-3H3.
What are the key properties of (2-cyclohexyl-1,1-dimethoxydecyl)benzene?
(2-cyclohexyl-1,1-dimethoxydecyl)benzene has a molecular weight of 360.58 g/mol, XLogP of 7.08, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-1,1-dimethoxydecyl)benzene is sourced from PubChem (CID 150097969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).