N,N',N''-triallylcyanuric acid | SBID = 718 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 3.0 | ||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | C12H15N3O3 | ||
| M / g/mol: | 249.2658 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: typical guest
- Name: N,N',N''-triallylcyanuric acid
- Preferred Abbreviation: N,N',N''-triallylcyanuric acid
- IUPAC Name:
- CAS:
- CID: -205
- InChiKey: KOMNUTZXSVSERR-UHFFFAOYSA-N
- InChi: InChI=1S/C12H15N3O3/c1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17/h4-6H,1-3,7-9H2
- CanoSmiles: C=CCN1C(N(C(N(CC=C)C1=O)=O)CC=C)=O
- IsoSmiles: C=CCN1C(N(C(N(CC=C)C1=O)=O)CC=C)=O
