bicyclo[4.2.0]octane;oxophosphane

C8H15OP — CID 174463373

IUPACbicyclo[4.2.0]octane;oxophosphane
SMILESC1CCC2CCC2C1.O=P
InChIInChI=1S/C8H14.HOP/c1-2-4-8-6-5-7(8)3-1;1-2/h7-8H,1-6H2;2H
InChIKeyOQJYFDHFWLBLAR-UHFFFAOYSA-N
MW158.18 g/mol
LogP3.06
Rot. Bonds

About bicyclo[4.2.0]octane;oxophosphane

bicyclo[4.2.0]octane;oxophosphane (PubChem CID 174463373) has the molecular formula C8H15OP and a molecular weight of 158.18 g/mol. Its IUPAC name is bicyclo[4.2.0]octane;oxophosphane.

Molecular Properties

Compound Namebicyclo[4.2.0]octane;oxophosphane
PubChem CID174463373
Molecular FormulaC8H15OP
Molecular Weight158.18 g/mol
Exact Mass158.09
IUPAC Namebicyclo[4.2.0]octane;oxophosphane
SMILESC1CCC2CCC2C1.O=P
InChIInChI=1S/C8H14.HOP/c1-2-4-8-6-5-7(8)3-1;1-2/h7-8H,1-6H2;2H
InChIKeyOQJYFDHFWLBLAR-UHFFFAOYSA-N
XLogP3.06
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.18
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-cyclohexyl-4-[4-[4-[4-[4-(4-cyclohexylcyclohexyl)cyclohexyl]cyclohexyl]cyclohexyl]cyclohexyl]cyclohexane
CID 123286414
tricyclo[11.9.0.05,8]docosane
CID 123241919
pentacyclo[23.18.0.05,21.08,16.029,41]tritetracontane
CID 123459742
hexacyclo[23.22.0.05,20.08,15.028,44.032,40]heptatetracontane
CID 123895586
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;λ2-plumbane
CID 173135911
CID 175877016
CID 175877016
cyclohexylcycloheptane
CID 524589
cyclopentylcyclopentane;phosphane
CID 174792657
(1R,5R)-bicyclo[3.2.0]heptane
CID 123536914
cyclononylcycloicosane
CID 123187062
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane;cyclopropane
CID 158726060

Frequently Asked Questions

What is the IUPAC name of bicyclo[4.2.0]octane;oxophosphane?
The IUPAC name of bicyclo[4.2.0]octane;oxophosphane (CID 174463373) is bicyclo[4.2.0]octane;oxophosphane.
What is the SMILES notation for bicyclo[4.2.0]octane;oxophosphane?
The canonical SMILES for bicyclo[4.2.0]octane;oxophosphane is C1CCC2CCC2C1.O=P.
What is the InChIKey of bicyclo[4.2.0]octane;oxophosphane?
The InChIKey is OQJYFDHFWLBLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14.HOP/c1-2-4-8-6-5-7(8)3-1;1-2/h7-8H,1-6H2;2H.
What are the key properties of bicyclo[4.2.0]octane;oxophosphane?
bicyclo[4.2.0]octane;oxophosphane has a molecular weight of 158.18 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[4.2.0]octane;oxophosphane is sourced from PubChem (CID 174463373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).