Basic information
- CAS
106287-90-5- Standard SMILES
COc1ccc2c(c1)c(CC(=O)O)c(C)n2CC(=O)c1ccccc1- InChIKey
VHLOZYACBUHUAV-UHFFFAOYSA-N- Molecular formula
- C20H19NO4
- Average molar mass
- 337.4 g/mol
- Monoisotopic mass
- 337.13140809
Names & identifiers
- Preferred name
- 1H-Indole-3-acetic acid, 5-methoxy-2-methyl-1-(2-oxo-2-phenylethyl)-
- IUPAC
- 2-(5-methoxy-2-methyl-1-phenacylindol-3-yl)acetic acid
- English name
- 2-(5-methoxy-2-methyl-1-phenacyl-indol-3-yl)acetic acid
- Molecular formula
- C20H19NO4
- Molecular weight
- 0
Names & synonyms
106287-90-5BRN 56214811H-INDOLE-3-ACETIC ACID, 5-METHOXY-2-METHYL-1-(2-OXO-2-PHENYLETHYL)-1-Phenacyl-2-methyl-5-methoxyindol-3-ylacetic acidDTXSID201475625-Methoxy-2-methyl-1-(2-oxo-2-phenylethyl)-1H-indole-3-acetic acidRefChem:239060DTXCID20700532-(5-methoxy-2-methyl-1-phenacylindol-3-yl)acetic acid2-(5-METHOXY-2-METHYL-1-PHENACYL-INDOL-3-YL)ACETIC ACID[5-methoxy-2-methyl-1-(2-oxo-2-phenylethyl)-1h-indol-3-yl]acetic acid
Database identifiers
- CAS
106287-90-5- PubChem CID
- 60125
- DTXSID
DTXSID20147562
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 488
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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