chloro-phenyl-dipropylsilane

C12H19ClSi — CID 57124380

IUPACchloro-phenyl-dipropylsilane
SMILESCCC[Si](Cl)(CCC)c1ccccc1
InChIInChI=1S/C12H19ClSi/c1-3-10-14(13,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyVXWBQENQUKPCBS-UHFFFAOYSA-N
MW226.82 g/mol
LogP3.90
Rot. Bonds5

About chloro-phenyl-dipropylsilane

chloro-phenyl-dipropylsilane (PubChem CID 57124380) has the molecular formula C12H19ClSi and a molecular weight of 226.82 g/mol. Its IUPAC name is chloro-phenyl-dipropylsilane.

Molecular Properties

Compound Namechloro-phenyl-dipropylsilane
PubChem CID57124380
Molecular FormulaC12H19ClSi
Molecular Weight226.82 g/mol
Exact Mass226.09
IUPAC Namechloro-phenyl-dipropylsilane
SMILESCCC[Si](Cl)(CCC)c1ccccc1
InChIInChI=1S/C12H19ClSi/c1-3-10-14(13,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyVXWBQENQUKPCBS-UHFFFAOYSA-N
XLogP3.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.82
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

iodo-phenyl-dipropylsilane
CID 150546600
dichloro-heptyl-phenylsilane
CID 101161411
butyl(trichloro)silane;dichloro(diphenyl)silane
CID 67532832
chloro-hexyl-iodo-phenylsilane
CID 154486835
chloro-methyl-octyl-phenylsilane
CID 66989770
diphenyl-bis(tripropylsilyloxy)silane
CID 139603904
phenoxy-diphenyl-propylsilane
CID 66773867
ethenyl-phenyl-dipropylsilane
CID 150519255
butyl-chloro-phenyl-propoxysilane
CID 140744872
butyl-chloro-ethenyl-phenylsilane
CID 67342810
N-(butyl-chloro-phenylsilyl)-N-ethylethanamine
CID 67277211
dichloro-(2-chloroethyl)-phenylsilane
CID 21404932

Frequently Asked Questions

What is the IUPAC name of chloro-phenyl-dipropylsilane?
The IUPAC name of chloro-phenyl-dipropylsilane (CID 57124380) is chloro-phenyl-dipropylsilane.
What is the SMILES notation for chloro-phenyl-dipropylsilane?
The canonical SMILES for chloro-phenyl-dipropylsilane is CCC[Si](Cl)(CCC)c1ccccc1.
What is the InChIKey of chloro-phenyl-dipropylsilane?
The InChIKey is VXWBQENQUKPCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClSi/c1-3-10-14(13,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of chloro-phenyl-dipropylsilane?
chloro-phenyl-dipropylsilane has a molecular weight of 226.82 g/mol, XLogP of 3.90, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-phenyl-dipropylsilane is sourced from PubChem (CID 57124380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).