(1-Benzyl-5-methoxy-1h-indol-3-yl)acetic acid
Basic information
- CAS
94005-21-7- Standard SMILES
COc1ccc2c(c1)c(CC(=O)O)cn2Cc1ccccc1- InChIKey
RLVBNWREQBWWMG-UHFFFAOYSA-N- Molecular formula
- C18H17NO3
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.1208434
Names & identifiers
- Preferred name
- (1-Benzyl-5-methoxy-1h-indol-3-yl)acetic acid
- IUPAC
- 2-(1-benzyl-5-methoxyindol-3-yl)acetic acid
Names & synonyms
94005-21-7(1-benzyl-5-methoxy-1h-indol-3-yl)acetic acidNSC54771NCIOpen2_001930SCHEMBL20769739DTXSID70288217
Database identifiers
- CAS
94005-21-7- PubChem CID
- 244152
- DTXSID
DTXSID70288217
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 51.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 381
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…