CID 134984577

C8H19BP — CID 134984577

IUPAC—
SMILESCCCCPC(C)(C)C.[B]
InChIInChI=1S/C8H19P.B/c1-5-6-7-9-8(2,3)4;/h9H,5-7H2,1-4H3;
InChIKeyIPBMRWLPPOSBKR-UHFFFAOYSA-N
MW157.03 g/mol
LogP2.88
Rot. Bonds3

About CID 134984577

CID 134984577 (PubChem CID 134984577) has the molecular formula C8H19BP and a molecular weight of 157.03 g/mol.

Molecular Properties

Compound NameCID 134984577
PubChem CID134984577
Molecular FormulaC8H19BP
Molecular Weight157.03 g/mol
Exact Mass157.13
IUPAC Name—
SMILESCCCCPC(C)(C)C.[B]
InChIInChI=1S/C8H19P.B/c1-5-6-7-9-8(2,3)4;/h9H,5-7H2,1-4H3;
InChIKeyIPBMRWLPPOSBKR-UHFFFAOYSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.03
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trifluoromethyl(undecyl)phosphane
CID 21096806
2,2-dimethylpropane;heptane
CID 144531055
bromo(butyl)phosphane
CID 142636402
pentane;tritert-butylphosphane
CID 175086214
butyl-(1-butyl-2-methyl-1-phosphanylhexyl)phosphane
CID 174916557
CID 18986095
CID 18986095
CID 159536102
CID 159536102
butyl(heptadecyl)phosphane
CID 146521828
CID 174389114
CID 174389114
butyl(propyl)phosphane;methane
CID 158586194
dipentylphosphane
CID 11105867
2,2-dimethylhexane
CID 169424592

Frequently Asked Questions

What is the IUPAC name of CID 134984577?
The IUPAC name of CID 134984577 (CID 134984577) is not available.
What is the SMILES notation for CID 134984577?
The canonical SMILES for CID 134984577 is CCCCPC(C)(C)C.[B].
What is the InChIKey of CID 134984577?
The InChIKey is IPBMRWLPPOSBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19P.B/c1-5-6-7-9-8(2,3)4;/h9H,5-7H2,1-4H3;.
What are the key properties of CID 134984577?
CID 134984577 has a molecular weight of 157.03 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134984577 is sourced from PubChem (CID 134984577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).