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MFCD01571059 molecular structure
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{7-chlorobicyclo[4.1.0]heptan-7-yl}trimethylsilane

ChemBase ID: 85331
Molecular Formular: C10H19ClSi
Molecular Mass: 202.79636
Monoisotopic Mass: 202.09445482
SMILES and InChIs

SMILES:
[Si](C1(C2C1CCCC2)Cl)(C)(C)C
Canonical SMILES:
ClC1(C2C1CCCC2)[Si](C)(C)C
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

Cite this record

CBID:85331 http://www.chembase.cn/molecule-85331.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
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
MDL Number
MFCD01571059
PubChem SID
162072447
PubChem CID
564487

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Apollo Scientific
OR28305 external link Add to cart Please log in.
Data Source Data ID
PubChem 564487 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.789  LogD (pH = 7.4) 4.789 
Log P 4.789  Molar Refractivity 50.5269 cm3
Polarizability 22.437979 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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