N-(3,4-dimethylphenyl)imidodicarbonimidic diamide
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Basic information
- CAS
49872-75-5- Standard SMILES
Cc1ccc(N=C(N)N=C(N)N)cc1C- InChIKey
VFRGNRZIYZQAOC-UHFFFAOYSA-N- Molecular formula
- C10H15N5
- Average molar mass
- 205.26 g/mol
- Monoisotopic mass
- 205.1327455
Names & identifiers
- Preferred name
- N-(3,4-dimethylphenyl)imidodicarbonimidic diamide
- IUPAC
- 1-(diaminomethylidene)-2-(3,4-dimethylphenyl)guanidine
- English name
- N-(3,4-Dimethylphenyl)imidodicarbonimidic diamide
- Molecular formula
- C10H15N5
- Molecular weight
- 205.26
Names & synonyms
N-(3,4-dimethylphenyl)imidodicarbonimidic diamide49872-75-51-(diaminomethylidene)-2-(3,4-dimethylphenyl)guanidineMFCD036154051-CARBAMIMIDAMIDO-N-(3,4-DIMETHYLPHENYL)METHANIMIDAMIDEimidodicarbonimidic diamide, n-(3,4-dimethylphenyl)-N-(3,4-Dimethylphenyl)triimidodicarbonic diamideNSC125218SCHEMBL9667362DTXSID40964455ALBB-021926STK100614
Show more names
Adagrasib Impurity 16
AKOS002225120NSC-125218LS-06734CS-0323057ST50106253H33321N-(3,4-dimethylphenyl)imidodicarbonimidicdiamide1-(diaminomethylene)-2-(3,4-dimethylphenyl)guanidine
Database identifiers
- CAS
49872-75-5- PubChem CID
- 276783
- DTXSID
DTXSID40964455- Nikkaji
- J155.951F
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
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Compound notes
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