7,8-dihydrobenzo[g]phosphinoline

C13H11P — CID 130290828

IUPAC7,8-dihydrobenzo[g]phosphinoline
SMILESC1=c2cc3cccpc3cc2=CCC1
InChIInChI=1S/C13H11P/c1-2-5-11-9-13-12(6-3-7-14-13)8-10(11)4-1/h3-9H,1-2H2
InChIKeyIOABYQQTFGDQBV-UHFFFAOYSA-N
MW198.20 g/mol
LogP2.77
Rot. Bonds

About 7,8-dihydrobenzo[g]phosphinoline

7,8-dihydrobenzo[g]phosphinoline (PubChem CID 130290828) has the molecular formula C13H11P and a molecular weight of 198.20 g/mol. Its IUPAC name is 7,8-dihydrobenzo[g]phosphinoline.

Molecular Properties

Compound Name7,8-dihydrobenzo[g]phosphinoline
PubChem CID130290828
Molecular FormulaC13H11P
Molecular Weight198.20 g/mol
Exact Mass198.06
IUPAC Name7,8-dihydrobenzo[g]phosphinoline
SMILESC1=c2cc3cccpc3cc2=CCC1
InChIInChI=1S/C13H11P/c1-2-5-11-9-13-12(6-3-7-14-13)8-10(11)4-1/h3-9H,1-2H2
InChIKeyIOABYQQTFGDQBV-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydrobenzo[g]phosphinoline?
The IUPAC name of 7,8-dihydrobenzo[g]phosphinoline (CID 130290828) is 7,8-dihydrobenzo[g]phosphinoline.
What is the SMILES notation for 7,8-dihydrobenzo[g]phosphinoline?
The canonical SMILES for 7,8-dihydrobenzo[g]phosphinoline is C1=c2cc3cccpc3cc2=CCC1.
What is the InChIKey of 7,8-dihydrobenzo[g]phosphinoline?
The InChIKey is IOABYQQTFGDQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11P/c1-2-5-11-9-13-12(6-3-7-14-13)8-10(11)4-1/h3-9H,1-2H2.
What are the key properties of 7,8-dihydrobenzo[g]phosphinoline?
7,8-dihydrobenzo[g]phosphinoline has a molecular weight of 198.20 g/mol, XLogP of 2.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydrobenzo[g]phosphinoline is sourced from PubChem (CID 130290828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).