Basic information
- CAS
5944-83-2- Standard SMILES
N=C(N)N.Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
DJAXCDIYFZEHGT-UHFFFAOYSA-N- Molecular formula
- C7H6Cl5N3O
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 322.89535
Names & identifiers
- Preferred name
- Guanidine-pentachlorophenol(1:1)
- IUPAC
- guanidine;2,3,4,5,6-pentachlorophenol
Names & synonyms
5944-83-2guanidine- pentachlorophenol(1:1)NSC85578DTXSID90292795Guanidine--pentachlorophenol (1/1)NSC-85578
Database identifiers
- CAS
5944-83-2- PubChem CID
- 257512
- DTXSID
DTXSID90292795
Properties
Computed structural properties
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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