Methylguanidinium | SBID = 1502 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 66.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.3 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 1.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| Number of H-Bond Acceptors: | 0.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 56.7 | ||
| Sum Formula: | C2H8N3+ | ||
| M / g/mol: | 74.11 | ||
| Complexity: | 42.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags:
- Name: Methylguanidinium
- Preferred Abbreviation: Methylguanidinium
- IUPAC Name: diaminomethylidene(methyl)azanium
- CAS:
- CID: 7311729
- InChiKey: CHJJGSNFBQVOTG-UHFFFAOYSA-O
- InChi: InChI=1S/C2H7N3/c1-5-2(3)4/h1H3,(H4,3,4,5)/p+1
- CanoSmiles: C[NH+]=C(N)N
- IsoSmiles: C[NH+]=C(N)N
