methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane

C15H17PSe — CID 86253016

IUPACmethyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane
SMILESCc1ccccc1P(C)(=[Se])c1ccccc1C
InChIInChI=1S/C15H17PSe/c1-12-8-4-6-10-14(12)16(3,17)15-11-7-5-9-13(15)2/h4-11H,1-3H3
InChIKeyZXUOIFNQCPNOEZ-UHFFFAOYSA-N
MW307.24 g/mol
LogP2.99
Rot. Bonds2

About methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane

methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane (PubChem CID 86253016) has the molecular formula C15H17PSe and a molecular weight of 307.24 g/mol. Its IUPAC name is methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane.

Molecular Properties

Compound Namemethyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane
PubChem CID86253016
Molecular FormulaC15H17PSe
Molecular Weight307.24 g/mol
Exact Mass308.02
IUPAC Namemethyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane
SMILESCc1ccccc1P(C)(=[Se])c1ccccc1C
InChIInChI=1S/C15H17PSe/c1-12-8-4-6-10-14(12)16(3,17)15-11-7-5-9-13(15)2/h4-11H,1-3H3
InChIKeyZXUOIFNQCPNOEZ-UHFFFAOYSA-N
XLogP2.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.24
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-dicyclopropylphosphoryl-2-methylbenzene
CID 167253001
1,2-xylene
CID 173422016
(2-methylphenyl)-diphenyl-sulfanylidene-lambda5-phosphane
CID 13238195
(2-methylphenyl)phosphonic acid;dihydrochloride
CID 70471914
1,2-xylene;trihydrochloride
CID 70594732
1,2-xylene;zirconium
CID 174354618
vanadium;1,2-xylene
CID 143581691
benzene;1,2-xylene
CID 161464493
1,2-xylene;tetrahydrobromide
CID 172843014
silver;1,2-xylene
CID 158486133
azane;1,2-xylene
CID 174280305
1-bis(2,3-dimethylphenyl)phosphoryl-2,3-dimethylbenzene
CID 118862460

Frequently Asked Questions

What is the IUPAC name of methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane?
The IUPAC name of methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane (CID 86253016) is methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane.
What is the SMILES notation for methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane?
The canonical SMILES for methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane is Cc1ccccc1P(C)(=[Se])c1ccccc1C.
What is the InChIKey of methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane?
The InChIKey is ZXUOIFNQCPNOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17PSe/c1-12-8-4-6-10-14(12)16(3,17)15-11-7-5-9-13(15)2/h4-11H,1-3H3.
What are the key properties of methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane?
methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane has a molecular weight of 307.24 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-bis(2-methylphenyl)-selanylidene-λ5-phosphane is sourced from PubChem (CID 86253016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).