(1-methyl-4-methylidenecyclohexyl)methylphosphane

C9H17P — CID 161459122

IUPAC(1-methyl-4-methylidenecyclohexyl)methylphosphane
SMILESC=C1CCC(C)(CP)CC1
InChIInChI=1S/C9H17P/c1-8-3-5-9(2,7-10)6-4-8/h1,3-7,10H2,2H3
InChIKeyLHKVHKCCAPQMBR-UHFFFAOYSA-N
MW156.21 g/mol
LogP3.00
Rot. Bonds1

About (1-methyl-4-methylidenecyclohexyl)methylphosphane

(1-methyl-4-methylidenecyclohexyl)methylphosphane (PubChem CID 161459122) has the molecular formula C9H17P and a molecular weight of 156.21 g/mol. Its IUPAC name is (1-methyl-4-methylidenecyclohexyl)methylphosphane.

Molecular Properties

Compound Name(1-methyl-4-methylidenecyclohexyl)methylphosphane
PubChem CID161459122
Molecular FormulaC9H17P
Molecular Weight156.21 g/mol
Exact Mass156.11
IUPAC Name(1-methyl-4-methylidenecyclohexyl)methylphosphane
SMILESC=C1CCC(C)(CP)CC1
InChIInChI=1S/C9H17P/c1-8-3-5-9(2,7-10)6-4-8/h1,3-7,10H2,2H3
InChIKeyLHKVHKCCAPQMBR-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1-methyl-3-methylidenecyclopentyl)methylphosphane
CID 161459121
4-methylidenecyclohexane-1,1-diol
CID 89206181
1,2,4-trimethyl-4-(2-methylpropyl)cyclohexene
CID 142035331
1,1-difluoro-3-methylidenecyclopentane;uranium
CID 142596182
1,1,7-trimethyl-4-methylidene-1b,2,3,5,6,6a,7,7a-octahydro-1aH-cyclopropa[a]azulene
CID 71335749
2-methylbutan-2-yl 1-methyl-4-methylidenecyclohexane-1-carboxylate
CID 90364766
1-[(1-methylcyclopropyl)methyl]-3-methylidenepiperidine
CID 131177029
1-(1-ethenyl-4-methylidenecyclohexyl)but-3-en-2-ol
CID 11480963
[3-methylidene-1-(2-methylpropyl)cyclopentyl]methanediol
CID 142115859
2-(1-methyl-3-methylidenecyclohexyl)acetonitrile
CID 10796911
1,1,3-trimethyl-2-methylidenecyclopentane
CID 102022448
3-ethyl-3,6-dimethyl-4,5-dihydro-2H-pyridine
CID 134923809

Frequently Asked Questions

What is the IUPAC name of (1-methyl-4-methylidenecyclohexyl)methylphosphane?
The IUPAC name of (1-methyl-4-methylidenecyclohexyl)methylphosphane (CID 161459122) is (1-methyl-4-methylidenecyclohexyl)methylphosphane.
What is the SMILES notation for (1-methyl-4-methylidenecyclohexyl)methylphosphane?
The canonical SMILES for (1-methyl-4-methylidenecyclohexyl)methylphosphane is C=C1CCC(C)(CP)CC1.
What is the InChIKey of (1-methyl-4-methylidenecyclohexyl)methylphosphane?
The InChIKey is LHKVHKCCAPQMBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17P/c1-8-3-5-9(2,7-10)6-4-8/h1,3-7,10H2,2H3.
What are the key properties of (1-methyl-4-methylidenecyclohexyl)methylphosphane?
(1-methyl-4-methylidenecyclohexyl)methylphosphane has a molecular weight of 156.21 g/mol, XLogP of 3.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-4-methylidenecyclohexyl)methylphosphane is sourced from PubChem (CID 161459122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).