Basic information
- CAS
75016-34-1- Standard SMILES
[2H]C([2H])(CCC)N(C)N=O- InChIKey
PKTSCJXWLVREKX-BFWBPSQCSA-N- Molecular formula
- C5H12N2O
- Average molar mass
- 118.17 g/mol
- Monoisotopic mass
- 118.1075165
Names & identifiers
- Preferred name
- Butylamine-1,1-d(sup 2), N-methyl-N-nitroso-
- IUPAC
- N-(1,1-dideuteriobutyl)-N-methylnitrous amide
Names & synonyms
Butylamine-1,1-d(sup 2), N-methyl-N-nitroso-75016-34-1NMBA-d2N-Nitroso-N-methyl-N-n-butyl-1-d(sup 2)-amineDTXSID00225998N-(1,1-~2~H_2_)Butyl-N-methylnitrous amide
Database identifiers
- CAS
75016-34-1- PubChem CID
- 198567
- DTXSID
DTXSID00225998
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 65.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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