N-o-tolyl-guanidine
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Basic information
- CAS
37557-40-7- Standard SMILES
Cc1ccccc1N=C(N)N- InChIKey
VVFVRTNNLLZXAL-UHFFFAOYSA-N- Molecular formula
- C8H11N3
- Average molar mass
- 149.19 g/mol
- Monoisotopic mass
- 149.09529736
Names & identifiers
- Preferred name
- N-o-tolyl-guanidine
- IUPAC
- 2-(2-methylphenyl)guanidine
- English name
- N-O-TOLYL-GUANIDINE
- Molecular formula
- C8H11N3
- Molecular weight
- 149.19
Names & synonyms
N-o-tolyl-guanidine37557-40-7DTXSID10328323RefChem:364682DTXCID402794301-(o-tolyl)guanidine1-(2-methylphenyl)guanidine2-(2-methylphenyl)guanidineMFCD04114636N''-(2-METHYLPHENYL)GUANIDINEtolylguanidineGuanidine, N-(2-methylphenyl)-
Show more names
N-(2-METHYLPHENYL)GUANIDINE2-(tolyl)guanidine2-(o-tolyl)guanidineSCHEMBL467514SCHEMBL1060976SCHEMBL1931049SCHEMBL3790728CHEMBL1160769
Database identifiers
- CAS
37557-40-7- PubChem CID
- 409363
- DTXSID
DTXSID10328323- ChEMBL
CHEMBL1160769
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Boiling point
- 243.2 · 243.2±33.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- pka
- 11.14 · 11.14±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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