(R)-Indenestrol B
Basic information
- CAS
115217-05-5- Standard SMILES
CC[C@H]1C(c2ccc(O)cc2)=C(C)c2cc(O)ccc21- InChIKey
HJVFIQKBLPQQDY-OAHLLOKOSA-N- Molecular formula
- C18H18O2
- Average molar mass
- 266.3 g/mol
- Monoisotopic mass
- 266.13067981
Overview
(R)-Indenestrol B is an indene.
Names & identifiers
- Preferred name
- (R)-Indenestrol B
- IUPAC
- (1R)-1-ethyl-2-(4-hydroxyphenyl)-3-methyl-1H-inden-5-ol
Names & synonyms
(R)-Indenestrol B115217-05-5Indenestrol B, (+)-(1R)-1-ethyl-2-(4-hydroxyphenyl)-3-methyl-1H-inden-5-ol(+)-indenestrol B5V6ZY5CC511H-Inden-5-ol, 1-ethyl-2-(4-hydroxyphenyl)-3-methyl-, (R)-UNII-5V6ZY5CC51CHEMBL73754CHEBI:34013(R)-1-Ethyl-2-(4-hydroxyphenyl)-3-methyl-1H-inden-5-olDTXSID90921654
Show more names
(+)-1-Ethyl-2-(4-hydroxyphenyl)-3-methyl-1H-inden-5-olQ271157521H-Inden-5-ol, 1-ethyl-2-(4-hydroxyphenyl)-3-methyl-, (1R)-
Database identifiers
- CAS
115217-05-5- PubChem CID
- 146495
- DTXSID
DTXSID90921654- ChEMBL
CHEMBL73754- ChEBI
CHEBI:34013- UNII
- 5V6ZY5CC51
- Nikkaji
- J453.992C
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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