Basic information
- CAS
106555-99-1- Standard SMILES
CCC(O)CN(CC(O)CC)N=O- InChIKey
MWHBHKQPXMHOEE-UHFFFAOYSA-N- Molecular formula
- C8H18N2O3
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.13174244
Names & identifiers
- Preferred name
- Bis(2-hydroxybutyl)nitrosamine
- IUPAC
- N,N-bis(2-hydroxybutyl)nitrous amide
Names & synonyms
Bis(2-hydroxybutyl)nitrosamine106555-99-1CCRIS 32162-BUTANOL, 1,1'-(NITROSOIMINO)BIS-N,N-bis(2-hydroxybutyl)nitrous amidenitrosobis(2-oxybutyl)amineDTXSID80910032
Database identifiers
- CAS
106555-99-1- PubChem CID
- 60150
- DTXSID
DTXSID80910032
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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