Basic information
- CAS
81257-95-6- Standard SMILES
COc1cc2cc[nH]c2c2c1OCCC2- InChIKey
IBUDEGUREFQMAE-UHFFFAOYSA-N- Molecular formula
- C12H13NO2
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.09462866
Names & identifiers
- Preferred name
- Pyrano(2,3-g)indole, 1,7,8,9-tetrahydro-5-methoxy-
- IUPAC
- 5-methoxy-1,7,8,9-tetrahydropyrano[2,3-g]indole
- English name
- 1,7,8,9-Tetrahydro-5-methoxypyrano(2,3-g)indole
- Molecular formula
- C12H13NO2
- Molecular weight
- 203.24
Names & synonyms
81257-95-6Pyrano(2,3-g)indole, 1,7,8,9-tetrahydro-5-methoxy-1,7,8,9-Tetrahydro-5-methoxypyrano(2,3-g)indole5-Methoxy-7,8,9-trihydro-pyranno(2,3-g)indole [French]5-Methoxy-7,8,9-trihydro-pyranno(2,3-g)indoleDTXSID10230997RefChem:375853DTXCID401534885-methoxy-1,7,8,9-tetrahydropyrano[2,3-g]indoleSCHEMBL10747138Pyrano[2,3-g]indole, 1,7,8,9-tetrahydro-5-methoxy-
Database identifiers
- CAS
81257-95-6- PubChem CID
- 3067321
- DTXSID
DTXSID10230997
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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