Basic information
- CAS
62018-88-6- Standard SMILES
O=NN(CCCCO)c1ccccc1- InChIKey
ABGKJHRBRJAENF-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- 4-(Nitrosophenylamino)-1-butanol
- IUPAC
- N-(4-hydroxybutyl)-N-phenylnitrous amide
Names & synonyms
4-(Nitrosophenylamino)-1-butanolYFB39JS5CS1-BUTANOL, 4-(NITROSOPHENYLAMINO)-DTXSID80211071PHENYL-N-(4-HYDROXYBUTYL)NITROSAMINE, N-RefChem:97544DTXCID80133562N-Phenyl-N-(4-hydroxybutyl)nitrosamine62018-88-6N-(4-hydroxybutyl)-N-phenylnitrous amideUNII-YFB39JS5CS
Database identifiers
- CAS
62018-88-6- PubChem CID
- 43869
- DTXSID
DTXSID80211071- UNII
- YFB39JS5CS
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…