alpha-Monofluoromethylputrescine
Basic information
- CAS
83306-45-0- Standard SMILES
NCC(N)CF- InChIKey
FGSNUVHKZPADQO-UHFFFAOYSA-N- Molecular formula
- C3H9FN2
- Average molar mass
- 92.12 g/mol
- Monoisotopic mass
- 92.07497646
Names & identifiers
- Preferred name
- alpha-Monofluoromethylputrescine
- IUPAC
- 3-fluoropropane-1,2-diamine
- English name
- alpha-Monofluoromethylputrescine
- Molecular formula
- C3H9FN2
- Molecular weight
- 92.12
Names & synonyms
alpha-Monofluoromethylputrescine83306-45-01,2-Propanediamine, 3-fluoro-, (+-)-RefChem:1113353-fluoropropane-1,2-diamineSCHEMBL16093339DTXSID401003289R.M.I. 718641,2-Propanediamine, 3-fluoro-
Database identifiers
- CAS
83306-45-0- PubChem CID
- 134201
- DTXSID
DTXSID401003289
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 32
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationSubstances and drugs that inhibit or block the activity of ORNITHINE DECARBOXYLASE.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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