7-methyl-1,4-dihydrocyclohepta[b]phosphole

C10H11P — CID 143779610

IUPAC7-methyl-1,4-dihydrocyclohepta[b]phosphole
SMILESCC1=Cc2[pH]ccc2CC=C1
InChIInChI=1S/C10H11P/c1-8-3-2-4-9-5-6-11-10(9)7-8/h2-3,5-7,11H,4H2,1H3
InChIKeyYDAFPYLHGRXMFN-UHFFFAOYSA-N
MW162.17 g/mol
LogP3.23
Rot. Bonds

About 7-methyl-1,4-dihydrocyclohepta[b]phosphole

7-methyl-1,4-dihydrocyclohepta[b]phosphole (PubChem CID 143779610) has the molecular formula C10H11P and a molecular weight of 162.17 g/mol. Its IUPAC name is 7-methyl-1,4-dihydrocyclohepta[b]phosphole.

Molecular Properties

Compound Name7-methyl-1,4-dihydrocyclohepta[b]phosphole
PubChem CID143779610
Molecular FormulaC10H11P
Molecular Weight162.17 g/mol
Exact Mass162.06
IUPAC Name7-methyl-1,4-dihydrocyclohepta[b]phosphole
SMILESCC1=Cc2[pH]ccc2CC=C1
InChIInChI=1S/C10H11P/c1-8-3-2-4-9-5-6-11-10(9)7-8/h2-3,5-7,11H,4H2,1H3
InChIKeyYDAFPYLHGRXMFN-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.17
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-1,4-dihydrocyclohepta[b]phosphole?
The IUPAC name of 7-methyl-1,4-dihydrocyclohepta[b]phosphole (CID 143779610) is 7-methyl-1,4-dihydrocyclohepta[b]phosphole.
What is the SMILES notation for 7-methyl-1,4-dihydrocyclohepta[b]phosphole?
The canonical SMILES for 7-methyl-1,4-dihydrocyclohepta[b]phosphole is CC1=Cc2[pH]ccc2CC=C1.
What is the InChIKey of 7-methyl-1,4-dihydrocyclohepta[b]phosphole?
The InChIKey is YDAFPYLHGRXMFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11P/c1-8-3-2-4-9-5-6-11-10(9)7-8/h2-3,5-7,11H,4H2,1H3.
What are the key properties of 7-methyl-1,4-dihydrocyclohepta[b]phosphole?
7-methyl-1,4-dihydrocyclohepta[b]phosphole has a molecular weight of 162.17 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1,4-dihydrocyclohepta[b]phosphole is sourced from PubChem (CID 143779610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).