Urea, N-(2,5-dimethylphenyl)-N'-(imino(methylamino)methyl)-, monohydrochloride
Basic information
- CAS
66871-62-3- Standard SMILES
CN=C(N)NC(=O)Nc1cc(C)ccc1C.Cl- InChIKey
YUDNRBAFYNMJRN-UHFFFAOYSA-N- Molecular formula
- C11H17ClN4O
- Average molar mass
- 256.73 g/mol
- Monoisotopic mass
- 256.1090889
Names & identifiers
- Preferred name
- Urea, N-(2,5-dimethylphenyl)-N'-(imino(methylamino)methyl)-, monohydrochloride
- IUPAC
- 1-(2,5-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea;hydrochloride
Names & synonyms
Urea, N-(2,5-dimethylphenyl)-N'-(imino(methylamino)methyl)-, monohydrochlorideUrea, 1-(2,5-dimethylphenyl)-3-methylamidino-, hydrochloride66871-62-3DTXSID70217022N-(2,5-Dimethylphenyl)-N'-(imino(methylamino)methyl)-urea hydrochlorideRefChem:387816DTXCID70139513N-(2,5-Dimethylphenyl)-N'-(N'-methylcarbamimidoyl)urea--hydrogen chloride (1/1)
Database identifiers
- CAS
66871-62-3- PubChem CID
- 3050656
- DTXSID
DTXSID70217022
Properties
Computed structural properties
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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