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38460-95-6 molecular structure
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undec-10-enoyl chloride

ChemBase ID: 147737
Molecular Formular: C11H19ClO
Molecular Mass: 202.72096
Monoisotopic Mass: 202.11244291
SMILES and InChIs

SMILES:
C=CCCCCCCCCC(=O)Cl
Canonical SMILES:
C=CCCCCCCCCC(=O)Cl
InChI:
InChI=1S/C11H19ClO/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2H,1,3-10H2
InChIKey:
MZFGYVZYLMNXGL-UHFFFAOYSA-N

Cite this record

CBID:147737 http://www.chembase.cn/molecule-147737.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
undec-10-enoyl chloride
IUPAC Traditional name
10-undecenoyl chloride
Synonyms
10-Undecenoyl chloride
10-十一酰氯
CAS Number
38460-95-6
EC Number
253-951-0
MDL Number
MFCD00000772
Beilstein Number
1635112
PubChem SID
162241921
24849945
24889775
PubChem CID
38042

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 38042 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.263081  LogD (pH = 7.4) 4.263081 
Log P 4.263081  Molar Refractivity 57.9812 cm3
Polarizability 22.672455 Å3 Polar Surface Area 17.07 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
120-122 °C/10 mmHg(lit.) expand Show data source
Flash Point
199.4 °F expand Show data source
93 °C expand Show data source
Density
0.944 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.454 expand Show data source
n20/D 1.454(lit.) expand Show data source
RTECS
YQ2991000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
3265 expand Show data source
MSDS Link
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
Risk Statements
34-37 expand Show data source
Safety Statements
26-36/37/39-45 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
GHS Precautionary statements
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 3265 8/PG 2 expand Show data source
Purity
≥97.0% (GC) expand Show data source
97% expand Show data source
Grade
technical expand Show data source
Linear Formula
CH2=CH(CH2)8COCl expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 161667 external link
Packaging
25, 100 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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