CID 59045042

C5H12P — CID 59045042

IUPAC—
SMILESCC[CH]C(C)P
InChIInChI=1S/C5H12P/c1-3-4-5(2)6/h4-5H,3,6H2,1-2H3
InChIKeyQBSUSYKSDKJMPZ-UHFFFAOYSA-N
MW103.13 g/mol
LogP1.86
Rot. Bonds2

About CID 59045042

CID 59045042 (PubChem CID 59045042) has the molecular formula C5H12P and a molecular weight of 103.13 g/mol.

Molecular Properties

Compound NameCID 59045042
PubChem CID59045042
Molecular FormulaC5H12P
Molecular Weight103.13 g/mol
Exact Mass103.07
IUPAC Name—
SMILESCC[CH]C(C)P
InChIInChI=1S/C5H12P/c1-3-4-5(2)6/h4-5H,3,6H2,1-2H3
InChIKeyQBSUSYKSDKJMPZ-UHFFFAOYSA-N
XLogP1.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.13
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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Frequently Asked Questions

What is the IUPAC name of CID 59045042?
The IUPAC name of CID 59045042 (CID 59045042) is not available.
What is the SMILES notation for CID 59045042?
The canonical SMILES for CID 59045042 is CC[CH]C(C)P.
What is the InChIKey of CID 59045042?
The InChIKey is QBSUSYKSDKJMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12P/c1-3-4-5(2)6/h4-5H,3,6H2,1-2H3.
What are the key properties of CID 59045042?
CID 59045042 has a molecular weight of 103.13 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59045042 is sourced from PubChem (CID 59045042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).