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Diepoxydihydromyrcene

HCID 44904
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Basic information

CAS
63869-17-0
Standard SMILES
C=C(CCC1OC1(C)C)C1CO1
InChIKey
AMZXMTLDFZJYKQ-UHFFFAOYSA-N
Molecular formula
C10H16O2
Average molar mass
168.23 g/mol
Monoisotopic mass
168.11502975

Names & identifiers

Preferred name
Diepoxydihydromyrcene
IUPAC
2,2-dimethyl-3-[3-(oxiran-2-yl)but-3-enyl]oxirane

Names & synonyms

Diepoxydihydromyrcene63869-17-01,6-OCTADIENE, DIEPOXYDIHYDRO-7-METHYL-3-METHYLENE-DTXSID309806092,2-Dimethyl-3-[3-(oxiran-2-yl)but-3-en-1-yl]oxirane

Database identifiers

CAS
63869-17-0
PubChem CID
44904
DTXSID
DTXSID30980609

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
25.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
208

Related reactions

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Compound notes

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