[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium

C14H13O2P — CID 174759796

IUPAC[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium
SMILESCc1cc(C)cc(-c2ccccc2[P+](=O)[O-])c1
InChIInChI=1S/C14H13O2P/c1-10-7-11(2)9-12(8-10)13-5-3-4-6-14(13)17(15)16/h3-9H,1-2H3
InChIKeyAMIZKVPMLPJPGW-UHFFFAOYSA-N
MW244.23 g/mol
LogP2.70
Rot. Bonds2

About [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium

[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium (PubChem CID 174759796) has the molecular formula C14H13O2P and a molecular weight of 244.23 g/mol. Its IUPAC name is [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium.

Molecular Properties

Compound Name[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium
PubChem CID174759796
Molecular FormulaC14H13O2P
Molecular Weight244.23 g/mol
Exact Mass244.07
IUPAC Name[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium
SMILESCc1cc(C)cc(-c2ccccc2[P+](=O)[O-])c1
InChIInChI=1S/C14H13O2P/c1-10-7-11(2)9-12(8-10)13-5-3-4-6-14(13)17(15)16/h3-9H,1-2H3
InChIKeyAMIZKVPMLPJPGW-UHFFFAOYSA-N
XLogP2.70
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.23
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1,3-dimethyl-5-(2-methylphenyl)benzene
CID 12639839
1,3-dimethyl-5-(2-nitrophenyl)benzene
CID 102025373
2-(3,5-dimethylphenyl)benzaldehyde
CID 61025926
1,3-dimethyl-5-phenylbenzene;methane
CID 143325792
1,3-dimethyl-5-(3-phenylphenyl)benzene;sulfane
CID 174481520
[2-(3,5-dimethylphenyl)phenyl] hydrogen carbonate
CID 150346527
lithium 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide
CID 22023088
1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
CID 123422549
3-(3,5-dimethylphenyl)-2-methylaniline
CID 107626341
1-(3,5-dimethylphenyl)-4-[3-(3,5-dimethylphenyl)phenyl]-2-phenylbenzene;1-[3-[2-[3-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,5-dimethylbenzene;bis(1-[3-[4-[3-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,5-dimethylbenzene)
CID 159368011
4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide;zirconium;dihydrochloride
CID 175331642
2-[2-(3,5-dimethylphenyl)-4-methylphenyl]phenol
CID 174881906

Frequently Asked Questions

What is the IUPAC name of [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium?
The IUPAC name of [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium (CID 174759796) is [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium.
What is the SMILES notation for [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium?
The canonical SMILES for [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium is Cc1cc(C)cc(-c2ccccc2[P+](=O)[O-])c1.
What is the InChIKey of [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium?
The InChIKey is AMIZKVPMLPJPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13O2P/c1-10-7-11(2)9-12(8-10)13-5-3-4-6-14(13)17(15)16/h3-9H,1-2H3.
What are the key properties of [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium?
[2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium has a molecular weight of 244.23 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-dimethylphenyl)phenyl]-oxido-oxophosphanium is sourced from PubChem (CID 174759796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).