Home > Compound List > Compound details
98-12-4 molecular structure
click picture or here to close

trichloro(cyclohexyl)silane

ChemBase ID: 151081
Molecular Formular: C6H11Cl3Si
Molecular Mass: 217.59604
Monoisotopic Mass: 215.96955992
SMILES and InChIs

SMILES:
C1CCC(CC1)[Si](Cl)(Cl)Cl
Canonical SMILES:
Cl[Si](C1CCCCC1)(Cl)Cl
InChI:
InChI=1S/C6H11Cl3Si/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2
InChIKey:
SIPHWXREAZVVNS-UHFFFAOYSA-N

Cite this record

CBID:151081 http://www.chembase.cn/molecule-151081.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trichloro(cyclohexyl)silane
IUPAC Traditional name
silane, trichlorocyclohexyl-
Synonyms
Cyclohexyltrichlorosilane
Trichlorocyclohexylsilane
Trichloro(cyclohexyl)silane
Trichlorocyclohexylsilane
Cyclohexyltrichlorosilane
环己基三氯硅烷
三氯环己基硅烷
环己基三氯硅烷
CAS Number
98-12-4
EC Number
202-639-2
MDL Number
MFCD00021280
Beilstein Number
2935257
PubChem SID
162245239
24864356
PubChem CID
60987

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 60987 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.4845  LogD (pH = 7.4) 3.4845 
Log P 3.4845  Molar Refractivity 44.996 cm3
Polarizability 19.581806 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
90 °C/10 mmHg(lit.) expand Show data source
90-91°C/10mm expand Show data source
Flash Point
201.2 °F expand Show data source
79°C(174°F) expand Show data source
94 °C expand Show data source
Density
1.232 expand Show data source
1.232 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4790 expand Show data source
n20/D 1.478(lit.) expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
1763 expand Show data source
UN1763 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
14-34 expand Show data source
Safety Statements
26-28-36/37/39-45 expand Show data source
26-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H314 expand Show data source
H314-H318-H227 expand Show data source
GHS Precautionary statements
P210-P260-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 1763 8/PG 2 expand Show data source
Purity
95+% expand Show data source
97+% expand Show data source
98% expand Show data source
Empirical Formula (Hill Notation)
C6H11Cl3Si expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 391069 external link
Packaging
5 mL in glass bottle

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle