5-methylbenzo[b]phosphindole

C13H11P — CID 5325075

IUPAC5-methylbenzo[b]phosphindole
SMILESCp1c2ccccc2c2ccccc21
InChIInChI=1S/C13H11P/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9H,1H3
InChIKeyZXNQSZACQNNQLT-UHFFFAOYSA-N
MW198.20 g/mol
LogP4.52
Rot. Bonds

About 5-methylbenzo[b]phosphindole

5-methylbenzo[b]phosphindole (PubChem CID 5325075) has the molecular formula C13H11P and a molecular weight of 198.20 g/mol. Its IUPAC name is 5-methylbenzo[b]phosphindole.

Molecular Properties

Compound Name5-methylbenzo[b]phosphindole
PubChem CID5325075
Molecular FormulaC13H11P
Molecular Weight198.20 g/mol
Exact Mass198.06
IUPAC Name5-methylbenzo[b]phosphindole
SMILESCp1c2ccccc2c2ccccc21
InChIInChI=1S/C13H11P/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9H,1H3
InChIKeyZXNQSZACQNNQLT-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.20
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-methylbenzo[b]phosphindole?
The IUPAC name of 5-methylbenzo[b]phosphindole (CID 5325075) is 5-methylbenzo[b]phosphindole.
What is the SMILES notation for 5-methylbenzo[b]phosphindole?
The canonical SMILES for 5-methylbenzo[b]phosphindole is Cp1c2ccccc2c2ccccc21.
What is the InChIKey of 5-methylbenzo[b]phosphindole?
The InChIKey is ZXNQSZACQNNQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11P/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9H,1H3.
What are the key properties of 5-methylbenzo[b]phosphindole?
5-methylbenzo[b]phosphindole has a molecular weight of 198.20 g/mol, XLogP of 4.52, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylbenzo[b]phosphindole is sourced from PubChem (CID 5325075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).