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CID 85778

HCID 85778
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
14840-89-2
Standard SMILES
CC1C=CCC(C)C2OC2CC(C)C=CC1
InChIKey
QPNXWGRYYRSVET-UHFFFAOYSA-N
Molecular formula
C15H24O
Average molar mass
220.35 g/mol
Monoisotopic mass
220.18271539

Names & identifiers

Preferred name
CID 85778
IUPAC
2,6,10-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
English name
2,6,10-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
Molecular formula
C15H24O
Molecular weight
220.35046

Names & synonyms

SCHEMBL29511485QPNXWGRYYRSVET-UHFFFAOYSA-NDTXSID501357667Einecs 238-903-92,6,10-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene13-Oxabicyclo(10.1.0)trideca-4,8-diene, 2,6,10-trimethyl-

Database identifiers

CAS
14840-89-2
PubChem CID
85778
DTXSID
DTXSID501357667

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
16
Formal charge
0
Complexity
279

Experimental & physicochemical properties

Endocrine DisruptorsPotential endocrine disrupting compound

Physicochemical properties

EPA Substance Registry System
13 · 13-Oxabicyclo[10.1.0]trideca-4,8-diene, 2,6,10-trimethyl- (14840-89-2)
TSCA
TSCA listed

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

tsca
TSCA listed

Chemistry & industry

Suppliers2 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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New reaction record

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes