1H-Indazolin-3-one, 6-amino-, dihydrochloride
Basic information
- CAS
55207-49-3- Standard SMILES
Cl.Cl.Nc1ccc2c(=O)[nH][nH]c2c1- InChIKey
ZHJVRKYJCFOXHT-UHFFFAOYSA-N- Molecular formula
- C7H9Cl2N3O
- Average molar mass
- 222.07 g/mol
- Monoisotopic mass
- 221.0122673
Names & identifiers
- Preferred name
- 1H-Indazolin-3-one, 6-amino-, dihydrochloride
- IUPAC
- 6-amino-1,2-dihydroindazol-3-one;dihydrochloride
Names & synonyms
NSC 87551EINECS 259-536-01H-Indazolin-3-one, 6-amino-, dihydrochloride3H-Indazol-3-one, 6-amino-1,2-dihydro-, dihydrochloride55207-49-3RefChem:2384203H-Indazol-3-one, 6-amino-1,2-dihydro-, dihydrochloride (9CI)6-Amino-1H,2H-indazol-3-one6-Amino-3-indazolinone dihydrochlorideNSC-87551X4QR4H5BM53-Indazolinone, 6-amino-, dihydrochloride
Show more names
6-amino-1,2-dihydroindazol-3-one;dihydrochloride3H-Indazol-3-one, 6-amino-1,2-dihydro-, hydrochloride (1:2)
Database identifiers
- CAS
55207-49-3- PubChem CID
- 198337
- UNII
- X4QR4H5BM5
- EC Number
- 259-536-0
Properties
Computed structural properties
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
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Compound notes
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