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1,2-Epoxycyclododeca-5,9-diene

HCID 79135
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Basic information

CAS
943-93-1
Standard SMILES
C1=CCCC2OC2CCC=CCC1
InChIKey
OWUVDWLTQIPNLN-UHFFFAOYSA-N
Molecular formula
C12H18O
Average molar mass
178.27 g/mol
Monoisotopic mass
178.1357652

Names & identifiers

Preferred name
1,2-Epoxycyclododeca-5,9-diene
IUPAC
13-oxabicyclo[10.1.0]trideca-4,8-diene
English name
9,10-Epoxy-1,5-cyclododecadiene
Molecular formula
C12H18O
Molecular weight
178.27

Names & synonyms

1,2-epoxycyclododeca-5,9-dieneCID 79135SCHEMBL328858DTXSID201034389DB-242981NSC 77113Ccris 3756Einecs 213-407-51 2-EPOXY-5 9-CYCLODODECADIENE1,5-CYCLODODECADIENE 9,10-OXIDE9,10-Epoxy-1,5-cyclododecadiene1,5-Cyclododecadiene-9,10-epoxide
Show more names
1,2-EPOXY-5,9-CYCLODODECANE-DIENE1 2-EPOXY-5 9-CYCLODODECADIENE 97%13-OXABICYCLO(10.1.0)TRIDECA-4,8-DIENE

Database identifiers

CAS
943-93-1
PubChem CID
79135
DTXSID
DTXSID201034389

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
183

Physicochemical properties

Boiling point
83 °C · 83°C 1mm
Density
0 · 0,98 g/cm3
Flash point
123 °C · 123 °C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H332-H319-H315-H302-H312
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
HS Code
2932990090 · 2932990090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2932990090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H332-H319-H315-H302-H312
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501

Chemistry & industry

Upstream & downstream products

Downstream products

Cyclododecanol

Suppliers

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Related reactions

10 records
New reaction record
HRID 672652 reaction equation
HRID 672652As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 982920 reaction equation
HRID 982920As reactantuspto-grants-2005_03
HRID 982921 reaction equation
HRID 982921As reactantuspto-grants-2005_03
HRID 1058207 reaction equation
HRID 1058207As reactantuspto-grants-2003_02
HRID 1058208 reaction equation
HRID 1058208As reactantuspto-grants-2003_02
HRID 1059265 reaction equation
HRID 1059265As reactantuspto-grants-2003_02
HRID 1250040 reaction equation
HRID 1250040As reactantuspto-grants-2002_01
HRID 1250041 reaction equation
HRID 1250041As reactantuspto-grants-2002_01
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Compound notes

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