dicyclohexylmethanol;prop-2-enylbenzene

C22H34O — CID 174723759

IUPACdicyclohexylmethanol;prop-2-enylbenzene
SMILESC=CCc1ccccc1.OC(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C13H24O.C9H10/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-6-9-7-4-3-5-8-9/h11-14H,1-10H2;2-5,7-8H,1,6H2
InChIKeyUZVJYMCYLLMTLK-UHFFFAOYSA-N
MW314.51 g/mol
LogP5.92
Rot. Bonds4

About dicyclohexylmethanol;prop-2-enylbenzene

dicyclohexylmethanol;prop-2-enylbenzene (PubChem CID 174723759) has the molecular formula C22H34O and a molecular weight of 314.51 g/mol. Its IUPAC name is dicyclohexylmethanol;prop-2-enylbenzene.

Molecular Properties

Compound Namedicyclohexylmethanol;prop-2-enylbenzene
PubChem CID174723759
Molecular FormulaC22H34O
Molecular Weight314.51 g/mol
Exact Mass314.26
IUPAC Namedicyclohexylmethanol;prop-2-enylbenzene
SMILESC=CCc1ccccc1.OC(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C13H24O.C9H10/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-6-9-7-4-3-5-8-9/h11-14H,1-10H2;2-5,7-8H,1,6H2
InChIKeyUZVJYMCYLLMTLK-UHFFFAOYSA-N
XLogP5.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.51
LogP ≤ 55.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

prop-2-enylbenzene
CID 159998516
ethane;ethenylcyclohexane;prop-2-enylbenzene;styrene
CID 164544485
prop-2-enylbenzene;dihydrochloride
CID 174768742
phosphane;prop-2-enylbenzene
CID 87328808
CID 173215164
CID 173215164
cyclohexyl-(2-prop-2-enylphenyl)methanol
CID 102302622
prop-2-enylbenzene;silicic acid;sulfane
CID 174871791
butylcyclohexane;ethene;prop-2-enylbenzene
CID 174813579
2-methylprop-1-ene;prop-2-enylbenzene
CID 142174904
(1R)-1-cyclopentyl-2-phenylethanol
CID 39238299
(1S)-N-benzyl-1-cyclohexylbut-3-en-1-amine
CID 10922765
benzene;hydroxy(oxo)phosphanium;prop-2-enylbenzene
CID 173443660

Frequently Asked Questions

What is the IUPAC name of dicyclohexylmethanol;prop-2-enylbenzene?
The IUPAC name of dicyclohexylmethanol;prop-2-enylbenzene (CID 174723759) is dicyclohexylmethanol;prop-2-enylbenzene.
What is the SMILES notation for dicyclohexylmethanol;prop-2-enylbenzene?
The canonical SMILES for dicyclohexylmethanol;prop-2-enylbenzene is C=CCc1ccccc1.OC(C1CCCCC1)C1CCCCC1.
What is the InChIKey of dicyclohexylmethanol;prop-2-enylbenzene?
The InChIKey is UZVJYMCYLLMTLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O.C9H10/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-6-9-7-4-3-5-8-9/h11-14H,1-10H2;2-5,7-8H,1,6H2.
What are the key properties of dicyclohexylmethanol;prop-2-enylbenzene?
dicyclohexylmethanol;prop-2-enylbenzene has a molecular weight of 314.51 g/mol, XLogP of 5.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexylmethanol;prop-2-enylbenzene is sourced from PubChem (CID 174723759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).