Basic information
- CAS
21484-53-7- Standard SMILES
O=C(O)Cc1nn(-c2ccccc2)c2c1CCCC2- InChIKey
RWNBBTAAUXWIMN-UHFFFAOYSA-N- Molecular formula
- C15H16N2O2
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.12117776
Names & identifiers
- Preferred name
- 1H-Indazole-3-acetic acid, 4,5,6,7-tetrahydro-1-phenyl-
- IUPAC
- 2-(1-phenyl-4,5,6,7-tetrahydroindazol-3-yl)acetic acid
Names & synonyms
Poli 391H-Indazole-3-acetic acid, 4,5,6,7-tetrahydro-1-phenyl-BRN 0543743DTXSID7017577921484-53-74,5,6,7-Tetrahydro-1-phenyl-1H-indazole-3-acetic acid5-25-04-00221 (Beilstein Handbook Reference)RefChem:238393DTXCID9098270(1-phenyl-4,5,6,7-tetrahydro-1h-indazol-3-yl)acetic acid
Database identifiers
- CAS
21484-53-7- PubChem CID
- 210672
- DTXSID
DTXSID70175779
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…