dichloro(4-phenylbutyl)silane

C10H14Cl2Si — CID 123661132

IUPACdichloro(4-phenylbutyl)silane
SMILESCl[SiH](Cl)CCCCc1ccccc1
InChIInChI=1S/C10H14Cl2Si/c11-13(12)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7,13H,4-5,8-9H2
InChIKeyBDLOYPXAQFIIJI-UHFFFAOYSA-N
MW233.21 g/mol
LogP3.71
Rot. Bonds5

About dichloro(4-phenylbutyl)silane

dichloro(4-phenylbutyl)silane (PubChem CID 123661132) has the molecular formula C10H14Cl2Si and a molecular weight of 233.21 g/mol. Its IUPAC name is dichloro(4-phenylbutyl)silane.

Molecular Properties

Compound Namedichloro(4-phenylbutyl)silane
PubChem CID123661132
Molecular FormulaC10H14Cl2Si
Molecular Weight233.21 g/mol
Exact Mass232.02
IUPAC Namedichloro(4-phenylbutyl)silane
SMILESCl[SiH](Cl)CCCCc1ccccc1
InChIInChI=1S/C10H14Cl2Si/c11-13(12)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7,13H,4-5,8-9H2
InChIKeyBDLOYPXAQFIIJI-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.21
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-phenylbutylbenzene
CID 141301927
hafnium;4-phenylbutylbenzene
CID 175889972
methane;4-phenylbutylbenzene
CID 173386802
1,4-bis(3-phenylpropyl)benzene
CID 59467322
CID 159131095
CID 159131095
13-phenyltridecan-1-amine
CID 19801439
4-phenylbutan-1-amine;hydrochloride
CID 44630065
benzene;3-phenylpropan-1-amine
CID 174865683
pentylbenzene
CID 91255123
4-chlorobutylbenzene;ethane
CID 142108519
heptylbenzene
CID 91456779
(5-chloro-4,4-dimethylpentyl)benzene
CID 66059754

Frequently Asked Questions

What is the IUPAC name of dichloro(4-phenylbutyl)silane?
The IUPAC name of dichloro(4-phenylbutyl)silane (CID 123661132) is dichloro(4-phenylbutyl)silane.
What is the SMILES notation for dichloro(4-phenylbutyl)silane?
The canonical SMILES for dichloro(4-phenylbutyl)silane is Cl[SiH](Cl)CCCCc1ccccc1.
What is the InChIKey of dichloro(4-phenylbutyl)silane?
The InChIKey is BDLOYPXAQFIIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2Si/c11-13(12)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7,13H,4-5,8-9H2.
What are the key properties of dichloro(4-phenylbutyl)silane?
dichloro(4-phenylbutyl)silane has a molecular weight of 233.21 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(4-phenylbutyl)silane is sourced from PubChem (CID 123661132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).