Home > Compound List > Compound details
111-19-3 molecular structure
click picture or here to close

decanedioyl dichloride

ChemBase ID: 104613
Molecular Formular: C10H16Cl2O2
Molecular Mass: 239.13884
Monoisotopic Mass: 238.05273511
SMILES and InChIs

SMILES:
ClC(=O)CCCCCCCCC(=O)Cl
Canonical SMILES:
ClC(=O)CCCCCCCCC(=O)Cl
InChI:
InChI=1S/C10H16Cl2O2/c11-9(13)7-5-3-1-2-4-6-8-10(12)14/h1-8H2
InChIKey:
WMPOZLHMGVKUEJ-UHFFFAOYSA-N

Cite this record

CBID:104613 http://www.chembase.cn/molecule-104613.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
decanedioyl dichloride
IUPAC Traditional name
decanedioyl dichloride
Synonyms
Sebacyl chloride
SEBACOYL CHLORIDE
Sebacoyl chloride
Decanedioyl dichloride
Octane-1,8-dicarbonyl chloride
氯化癸二酰
癸二酰氯
CAS Number
111-19-3
EC Number
203-843-4
MDL Number
MFCD00000770
Beilstein Number
1365665
PubChem SID
24854167
162092788
24888277
PubChem CID
66072

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Polar Surface Area 34.14 Å2 Rotatable Bonds
Lipinski's Rule of Five true  H Acceptors
H Donor LogD (pH = 5.5) 3.3355882 
LogD (pH = 7.4) 3.3355882  Log P 3.3355882 
Molar Refractivity 58.86 cm3 Polarizability 23.087458 Å3

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
yellow liquid expand Show data source
Melting Point
-2°C expand Show data source
-5°C expand Show data source
-5--3 °C(lit.) expand Show data source
Boiling Point
161°C/14mm expand Show data source
168 °C/12 mmHg(lit.) expand Show data source
168°C expand Show data source
Flash Point
113 °C expand Show data source
165°C(329°F) expand Show data source
235.4 °F expand Show data source
Density
1.119 g/mL at 20 °C expand Show data source
1.121 expand Show data source
1.121 g/ml expand Show data source
1.121 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4680 expand Show data source
n20/D 1.468 expand Show data source
n20/D 1.468(lit.) expand Show data source
Storage Condition
2-8°C, Desiccate expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
RTECS
HD8454250 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
1760 expand Show data source
3265 expand Show data source
UN2922 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
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
III expand Show data source
Australian Hazchem
2X expand Show data source
Risk Statements
22-24-34 expand Show data source
R:14-34 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
S:27/28-30-36/37/39-45 expand Show data source
EU Classification
C9 expand Show data source
EU Hazard Identification Number
8B expand Show data source
Emergency Response Guidebook(ERG) Number
154 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H310-H314-H318 expand Show data source
H302-H310-H314 expand Show data source
GHS Precautionary statements
P260-P301+P310-P303+P361+P353-P305+P351+P338-P361-P405-P501A expand Show data source
P280-P302 + P350-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 3265 8/PG 2 expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
>90% expand Show data source
≥95.0% (GC) expand Show data source
≥97% expand Show data source
≥99.0% (T) expand Show data source
92% expand Show data source
97% expand Show data source
99% expand Show data source
Grade
CP expand Show data source
puriss. expand Show data source
purum expand Show data source
technical grade expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
ClCO(CH2)8COCl expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02156596 external link
Purity: >90%
Faint yellow liquid.
1 ml = approx. 1.12 g
Sigma Aldrich - 236365 external link
Packaging
10, 50 g in glass bottle
Sigma Aldrich - 131784 external link
Other Notes
may contain a small amount of hydrolysis products
Packaging
50, 250, 500 g 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