CID 11278244

C12H12P — CID 11278244

IUPAC
SMILESC[P@@]([C]1[CH][CH][CH][CH]1)c1ccccc1
InChIInChI=1S/C12H12P/c1-13(12-9-5-6-10-12)11-7-3-2-4-8-11/h2-10H,1H3/t13-/m1/s1
InChIKeyQJWXNZJIUNTLLU-CYBMUJFWSA-N
MW187.20 g/mol
LogP2.79
Rot. Bonds2

About CID 11278244

CID 11278244 (PubChem CID 11278244) has the molecular formula C12H12P and a molecular weight of 187.20 g/mol.

Molecular Properties

Compound NameCID 11278244
PubChem CID11278244
Molecular FormulaC12H12P
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name
SMILESC[P@@]([C]1[CH][CH][CH][CH]1)c1ccccc1
InChIInChI=1S/C12H12P/c1-13(12-9-5-6-10-12)11-7-3-2-4-8-11/h2-10H,1H3/t13-/m1/s1
InChIKeyQJWXNZJIUNTLLU-CYBMUJFWSA-N
XLogP2.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 52.79
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 11278244?
The IUPAC name of CID 11278244 (CID 11278244) is not available.
What is the SMILES notation for CID 11278244?
The canonical SMILES for CID 11278244 is C[P@@]([C]1[CH][CH][CH][CH]1)c1ccccc1.
What is the InChIKey of CID 11278244?
The InChIKey is QJWXNZJIUNTLLU-CYBMUJFWSA-N. The full InChI is InChI=1S/C12H12P/c1-13(12-9-5-6-10-12)11-7-3-2-4-8-11/h2-10H,1H3/t13-/m1/s1.
What are the key properties of CID 11278244?
CID 11278244 has a molecular weight of 187.20 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11278244 is sourced from PubChem (CID 11278244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).