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Molecule
ID:85331
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₁₉ClSi
Molecular Mass
202.79636
Exact Mass
202.09445482
Charge
0
InChI
InChI=1S/C10H19ClSi/c1-12(2,3)10(11)8-6-4-5-7-9(8)10/h8-9H,4-7H2,1-3H3
InChIKey
QUVSFLPVWFIKGB-UHFFFAOYSA-N
Canonic Smiles
ClC1(C2C1CCCC2)[Si](C)(C)C
Isomeric Smiles
[Si](C1(C2C1CCCC2)Cl)(C)(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.789
LogD (pH = 7.4)
4.789
Log P
4.789
Molar Refractivity
50.5269
Polarizability
22.437979
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
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Molecule Details
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General Information
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From Data Sources
Bioactivity
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Data Source
Academic Data
PubChem
564487
Commercial Catalog
Apollo Scientific
OR28305
Names and Identifiers
IUPAC name
{7-chlorobicyclo[4.1.0]heptan-7-yl}trimethylsilane
IUPAC Traditional name
{7-chlorobicyclo[4.1.0]heptan-7-yl}trimethylsilane
Synonyms
(7-chlorobicyclo[4.1.0]hept-7-yl)(trimethyl)silane
Registration numbers
MDL Number
MFCD01571059
PubChem CID
564487
PubChem SID
162072447
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay