1-Imino-1H-inden-3-amine monohydrochloride
Basic information
- CAS
40951-52-8- Standard SMILES
Cl.N=C1C=C(N)c2ccccc21- InChIKey
CGRJFYBAQDJOPJ-UHFFFAOYSA-N- Molecular formula
- C9H9ClN2
- Average molar mass
- 180.63 g/mol
- Monoisotopic mass
- 180.045426
Names & identifiers
- Preferred name
- 1-Imino-1H-inden-3-amine monohydrochloride
- IUPAC
- 3-iminoinden-1-amine;hydrochloride
Names & synonyms
40951-52-81-Imino-1H-inden-3-amine monohydrochloride1H-Inden-3-amine, 1-imino-, monohydrochlorideDTXSID809613271-Imino-1H-inden-3-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
40951-52-8- PubChem CID
- 148402
- DTXSID
DTXSID80961327
Properties
Computed structural properties
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 218
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Related reactions
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Compound notes
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