Dichloroethenylbenzene
Basic information
- CAS
50507-89-6- Standard SMILES
CCS(=O)(=O)O.CN(C)C(=O)COc1ccc(N2C(N)=NC(N)=NC2(C)C)cc1Cl- InChIKey
UBVRWMBWDONRAD-UHFFFAOYSA-N- Molecular formula
- C17H27ClN6O5S
- Average molar mass
- 463 g/mol
- Monoisotopic mass
- 462.1452169
Names & identifiers
- Preferred name
- Dichloroethenylbenzene
- IUPAC
- 2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-N,N-dimethylacetamide;ethanesulfonic acid
Names & synonyms
50507-89-6DichloroethenylbenzeneNSC140388DTXSID90301018NSC-140388DS-0128122-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-N,N-dimethyl-acetamideEthanesulfonic acid--2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]-N,N-dimethylacetamide (1/1)
Database identifiers
- CAS
50507-89-6- PubChem CID
- 284552
- DTXSID
DTXSID90301018
Properties
Computed structural properties
- Topological polar surface area
- 172 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 653
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…