Basic information
- CAS
21677-49-6- Standard SMILES
Cn1nc2c(c1CC(=O)O)CCCC2- InChIKey
XIMALPFIKGOUGQ-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- 2H-Indazole-3-acetic acid, 4,5,6,7-tetrahydro-2-methyl-
- IUPAC
- 2-(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)acetic acid
Names & synonyms
21677-49-62-(2-methyl-4,5,6,7-tetrahydro-2H-indazol-3-yl)acetic acid2H-Indazole-3-acetic acid, 4,5,6,7-tetrahydro-2-methyl-2-(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)acetic acidPoli 144(2-methyl-4,5,6,7-tetrahydro-2h-indazol-3-yl)acetic acidBRN 0613374SCHEMBL15204864,5,6,7-Tetrahydro-2-methyl-2H-indazole-3-acetic acidDTXSID30176060AKOS023610716EN300-1139005
Show more names
F1910-00812-(2-methyl-4,5,6,7-tetrahydro-2H-indazol-3-yl)aceticacid
Database identifiers
- CAS
21677-49-6- PubChem CID
- 210809
- DTXSID
DTXSID30176060
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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