3,4,5-trimethylbenzo[b]phosphindole

C15H15P — CID 118221152

IUPAC3,4,5-trimethylbenzo[b]phosphindole
SMILESCc1ccc2c3ccccc3p(C)c2c1C
InChIInChI=1S/C15H15P/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2/h4-9H,1-3H3
InChIKeyHINDCQOBXJILIR-UHFFFAOYSA-N
MW226.26 g/mol
LogP5.13
Rot. Bonds

About 3,4,5-trimethylbenzo[b]phosphindole

3,4,5-trimethylbenzo[b]phosphindole (PubChem CID 118221152) has the molecular formula C15H15P and a molecular weight of 226.26 g/mol. Its IUPAC name is 3,4,5-trimethylbenzo[b]phosphindole.

Molecular Properties

Compound Name3,4,5-trimethylbenzo[b]phosphindole
PubChem CID118221152
Molecular FormulaC15H15P
Molecular Weight226.26 g/mol
Exact Mass226.09
IUPAC Name3,4,5-trimethylbenzo[b]phosphindole
SMILESCc1ccc2c3ccccc3p(C)c2c1C
InChIInChI=1S/C15H15P/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2/h4-9H,1-3H3
InChIKeyHINDCQOBXJILIR-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500226.26
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3,5-dimethyl-4-propan-2-ylbenzo[b]phosphindole
CID 134510981
1,2-dimethyltriphenylene;ethane
CID 145144770
2-(5-methylbenzo[b]phosphindol-4-yl)-6-phenylpyridine
CID 140916705
1-methylphosphindole-2,3-dithiol
CID 139125832
9,10-dimethylanthracene;1,4-dimethylnaphthalene;methane
CID 160811650
1,2-dimethylnaphthalene;ethane
CID 90922397
ethane;1,2,5-trimethylnaphthalene
CID 142394206
1,2-dimethylnaphthalene;hydrobromide
CID 174429192
1,2-dimethyl-5-phenylnaphthalene
CID 171799128
5,6,9,10-tetramethylphenanthridin-5-ium
CID 157300513
1,2-dimethylnaphthalene;ethane;propane
CID 90958253
benzo[b]phosphindol-5-yl(trimethyl)silane
CID 22151215

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethylbenzo[b]phosphindole?
The IUPAC name of 3,4,5-trimethylbenzo[b]phosphindole (CID 118221152) is 3,4,5-trimethylbenzo[b]phosphindole.
What is the SMILES notation for 3,4,5-trimethylbenzo[b]phosphindole?
The canonical SMILES for 3,4,5-trimethylbenzo[b]phosphindole is Cc1ccc2c3ccccc3p(C)c2c1C.
What is the InChIKey of 3,4,5-trimethylbenzo[b]phosphindole?
The InChIKey is HINDCQOBXJILIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15P/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2/h4-9H,1-3H3.
What are the key properties of 3,4,5-trimethylbenzo[b]phosphindole?
3,4,5-trimethylbenzo[b]phosphindole has a molecular weight of 226.26 g/mol, XLogP of 5.13, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethylbenzo[b]phosphindole is sourced from PubChem (CID 118221152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).