Basic information
- CAS
93777-40-3- Standard SMILES
CC1CCC2(CC3CC2C2CCCC32)O1- InChIKey
CYMMPGKBOROHLH-UHFFFAOYSA-N- Molecular formula
- C14H22O
- Average molar mass
- 206.32 g/mol
- Monoisotopic mass
- 206.16706532
Names & identifiers
- Preferred name
- decahydro-5-methylspiro[furan-2(3H),5'-[4,7]methano[5H]indene]
- IUPAC
- 5-methylspiro[oxolane-2,8'-tricyclo[5.2.1.02,6]decane]
- English name
- decahydro-5-methylspiro[furan-2(3H),5'-[4,7]methano[5H]indene]
- Molecular formula
- C14H22O
- Molecular weight
- 206.32
Names & synonyms
93777-40-3EINECS 298-071-8Decahydro-5-methylspiro[furan-2(3H),5'-[4,7]methano[5H]indene]Decahydro-5-methylspiro(furan-2(3H),5'-(4,7)methano(5H)indene)RefChem:131163298-071-8DTXSID50918065CYMMPGKBOROHLH-UHFFFAOYSA-NNS000641635'-Methyloctahydrospiro[4,7-methanoindene-5,2'-oxolane]Spiro[furan-2(3H),5'-[4,7]methano[5H]indene], decahydro-5-methyl-
Database identifiers
- CAS
93777-40-3- PubChem CID
- 44153175
- DTXSID
DTXSID50918065- EC Number
- 298-071-8
- Nikkaji
- J348.688E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 287
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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