(11-Oxa-tricyclo[4.4.1.0^1,6]undec-8-en-2-yl)-methanol
Basic information
- CAS
151831-51-5- Standard SMILES
OC[C@H]1CCC[C@]23CC=CC[C@]12O3- InChIKey
LDTDZDZWFJWFKS-MXWKQRLJSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Names & identifiers
- Preferred name
- (11-Oxa-tricyclo[4.4.1.0^1,6]undec-8-en-2-yl)-methanol
- IUPAC
- [(1S,2R,6S)-11-oxatricyclo[4.4.1.01,6]undec-8-en-2-yl]methanol
Names & synonyms
(11-Oxa-tricyclo[4.4.1.0^1,6]undec-8-en-2-yl)-methanolDTXSID701138966151831-51-5(4R,4aS,8aS)-4a,8a-Epoxy-1,2,3,4,4a,5,8,8a-octahydronaphthalene-4-methanol[(1R,4aS,8aS)-1,2,3,4,5,8-Hexahydro-4a,8a-epoxynaphthalen-1-yl]methanol4a,8a-epoxynaphthalene-1-methanol, 1,2,3,4,5,8-hexahydro-, (1R,4aS,8aS)-rel-(1R,4aS,8aS)-1,2,3,4,5,8-hexahydro-4a,8a-epoxynaphthalen-1-ylmethanol4a,8a-Epoxynaphthalene-1-methanol, 1,2,3,4,5,8-hexahydro-, [1R-(1I+/-,4aI+/-,8aI+/-)]-InChI=1/C11H16O2/c12-8-9-4-3-6-10-5-1-2-7-11(9,10)13-10/h1-2,9,12H,3-8H2/t9-,10-,11+/m1/s
Database identifiers
- CAS
151831-51-5- PubChem CID
- 641685
- DTXSID
DTXSID701138966- Nikkaji
- J627.635K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 261
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…