Acetic acid;2-(4-chlorophenyl)-1-(diaminomethylidene)guanidine
Basic information
- CAS
41610-49-5- Standard SMILES
CC(=O)O.NC(N)=NC(N)=Nc1ccc(Cl)cc1- InChIKey
RXBLZRXDBWHMHX-UHFFFAOYSA-N- Molecular formula
- C10H14ClN5O2
- Average molar mass
- 271.7 g/mol
- Monoisotopic mass
- 271.0836024
Names & identifiers
- Preferred name
- Acetic acid;2-(4-chlorophenyl)-1-(diaminomethylidene)guanidine
- IUPAC
- acetic acid;2-(4-chlorophenyl)-1-(diaminomethylidene)guanidine
Names & synonyms
41610-49-5NSC14718DTXSID10279947NSC-14718Acetic acid--N''-(4-chlorophenyl)-N-(diaminomethylidene)guanidine (1/1)Acetic acid--N''-[N'-(4-chlorophenyl)carbamimidoyl]guanidine (1/1)
Database identifiers
- CAS
41610-49-5- PubChem CID
- 225403
- DTXSID
DTXSID10279947
Properties
Computed structural properties
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 269
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Compound notes
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