phenylsilane

C6H8Si — CID 12752

IUPACphenylsilane
SMILES[SiH3]c1ccccc1
InChIInChI=1S/C6H8Si/c7-6-4-2-1-3-5-6/h1-5H,7H3
InChIKeyPARWUHTVGZSQPD-UHFFFAOYSA-N
MW108.22 g/mol
LogP-0.32
Rot. Bonds

About phenylsilane

phenylsilane (PubChem CID 12752) has the molecular formula C6H8Si and a molecular weight of 108.22 g/mol. Its IUPAC name is phenylsilane.

Molecular Properties

Compound Namephenylsilane
PubChem CID12752
Molecular FormulaC6H8Si
Molecular Weight108.22 g/mol
Exact Mass108.04
IUPAC Namephenylsilane
SMILES[SiH3]c1ccccc1
InChIInChI=1S/C6H8Si/c7-6-4-2-1-3-5-6/h1-5H,7H3
InChIKeyPARWUHTVGZSQPD-UHFFFAOYSA-N
XLogP-0.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.22
LogP ≤ 5-0.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Benzene
CID 241
Phenylmercuric Chloride
CID 7511
Phenyltrichlorosilane
CID 7372
Dichloromethylphenylsilane
CID 9006
Ethylphenyldichlorosilane
CID 14304
Trimethoxyphenylsilane
CID 18137
Benzene-D6
CID 71601
Difluorodiphenylsilane
CID 67557
Benzeneselenol
CID 69530
Trichloro(dichlorophenyl)silane
CID 156614055
Phenyl mercuric bromide
CID 14509
Phenyl Dimethicone
CID 3032548

Frequently Asked Questions

What is the IUPAC name of phenylsilane?
The IUPAC name of phenylsilane (CID 12752) is phenylsilane.
What is the SMILES notation for phenylsilane?
The canonical SMILES for phenylsilane is [SiH3]c1ccccc1.
What is the InChIKey of phenylsilane?
The InChIKey is PARWUHTVGZSQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8Si/c7-6-4-2-1-3-5-6/h1-5H,7H3.
What are the key properties of phenylsilane?
phenylsilane has a molecular weight of 108.22 g/mol, XLogP of -0.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenylsilane is sourced from PubChem (CID 12752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).