2',3'-dihydro-3',3'-dimethylspiro[cyclohexane-1,1'-[1H]indene]-5'-ol
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Basic information
- CAS
53718-33-5- Standard SMILES
CC1(C)CC2(CCCCC2)c2ccc(O)cc21- InChIKey
FVHTZOXYTGZSNE-UHFFFAOYSA-N- Molecular formula
- C16H22O
- Average molar mass
- 230.34 g/mol
- Monoisotopic mass
- 230.16706532
Names & identifiers
- Preferred name
- 2',3'-dihydro-3',3'-dimethylspiro[cyclohexane-1,1'-[1H]indene]-5'-ol
- IUPAC
- 3,3-dimethylspiro[2H-indene-1,1'-cyclohexane]-5-ol
- English name
- 2',3'-dihydro-3',3'-dimethylspiro[cyclohexane-1,1'-[1H]indene]-5'-ol
- Molecular formula
- C16H22O
- Molecular weight
- 230.35
Names & synonyms
53718-33-52',3'-dihydro-3',3'-dimethylspiro[cyclohexane-1,1'-[1H]indene]-5'-ol2',3'-Dihydro-3',3'-dimethylspiro(cyclohexane-1,1'-(1H)indene)-5'-olEINECS 258-721-33',3'-dimethyl-2',3'-dihydrospiro[cyclohexane-1,1'-inden]-5'-olD6G6M3YNS7SCHEMBL11159743DTXSID20201976FVHTZOXYTGZSNE-UHFFFAOYSA-NDB-302837NS000328242',3'-Dihydro-3',3'-dimethylspiro[cyclohexane-1,1'-[1H]inden]-5'-ol
Show more names
2,3-Dihydro-3,3-dimethylspiro[1H-indene-1,1'-cyclohexan]-5-ol
Spiro[cyclohexane-1,1'-[1H]inden]-5'-ol, 2',3'-dihydro-3',3'-dimethyl-
Database identifiers
- CAS
53718-33-5- PubChem CID
- 104572
- DTXSID
DTXSID20201976- UNII
- D6G6M3YNS7
- EC Number
- 258-721-3
- Nikkaji
- J296.025G
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 288
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Related reactions
0 records
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Compound notes
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