cyclobutane;molecular hydrogen;phosphane

C4H13P — CID 174886457

IUPACcyclobutane;molecular hydrogen;phosphane
SMILESC1CCC1.P.[H][H]
InChIInChI=1S/C4H8.H3P.H2/c1-2-4-3-1;;/h1-4H2;1H3;1H
InChIKeyMVNFJDSELJPHLA-UHFFFAOYSA-N
MW92.12 g/mol
LogP1.86
Rot. Bonds

About cyclobutane;molecular hydrogen;phosphane

cyclobutane;molecular hydrogen;phosphane (PubChem CID 174886457) has the molecular formula C4H13P and a molecular weight of 92.12 g/mol. Its IUPAC name is cyclobutane;molecular hydrogen;phosphane.

Molecular Properties

Compound Namecyclobutane;molecular hydrogen;phosphane
PubChem CID174886457
Molecular FormulaC4H13P
Molecular Weight92.12 g/mol
Exact Mass92.08
IUPAC Namecyclobutane;molecular hydrogen;phosphane
SMILESC1CCC1.P.[H][H]
InChIInChI=1S/C4H8.H3P.H2/c1-2-4-3-1;;/h1-4H2;1H3;1H
InChIKeyMVNFJDSELJPHLA-UHFFFAOYSA-N
XLogP1.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.12
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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cyclopentane;phosphane
CID 70501903
cyclooctacosane
CID 520451
cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane
CID 159212715
cyclooctane
CID 9266
cyclobutane;cyclopropane
CID 159057906
cyclopentane
CID 141332554
cycloheptane;cyclopropane
CID 165090184
magnesium cyclohexane
CID 23347282
cycloheptane;silane
CID 158344196
cyclobutane;methane
CID 159348077
bis(cyclopentane);hydrate
CID 19957864

Frequently Asked Questions

What is the IUPAC name of cyclobutane;molecular hydrogen;phosphane?
The IUPAC name of cyclobutane;molecular hydrogen;phosphane (CID 174886457) is cyclobutane;molecular hydrogen;phosphane.
What is the SMILES notation for cyclobutane;molecular hydrogen;phosphane?
The canonical SMILES for cyclobutane;molecular hydrogen;phosphane is C1CCC1.P.[H][H].
What is the InChIKey of cyclobutane;molecular hydrogen;phosphane?
The InChIKey is MVNFJDSELJPHLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.H3P.H2/c1-2-4-3-1;;/h1-4H2;1H3;1H.
What are the key properties of cyclobutane;molecular hydrogen;phosphane?
cyclobutane;molecular hydrogen;phosphane has a molecular weight of 92.12 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutane;molecular hydrogen;phosphane is sourced from PubChem (CID 174886457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).