Basic information
- CAS
1248106-82-2- Standard SMILES
CC(C)N=C(N)Nc1ccc2c(c1)CCC2- InChIKey
UDSZRRYZKDWPMR-UHFFFAOYSA-N- Molecular formula
- C13H19N3
- Average molar mass
- 217.31 g/mol
- Monoisotopic mass
- 217.15789762
Names & identifiers
- Preferred name
- N-(2,3-Dihydro-1H-inden-5-yl)-N'-propan-2-ylguanidine
- IUPAC
- 1-(2,3-dihydro-1H-inden-5-yl)-2-propan-2-ylguanidine
Names & synonyms
DTXSID101195958AKOS011667500N-(2,3-Dihydro-1H-inden-5-yl)-N'-propan-2-ylguanidineN-(2,3-Dihydro-1H-inden-5-yl)-Na(2)-(1-methylethyl)guanidine1248106-82-2
Database identifiers
- CAS
1248106-82-2- PubChem CID
- 62380906
- DTXSID
DTXSID101195958
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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