(3-Fluorocyclobutyl)methanamine
Basic information
- CAS
1260664-80-9- Standard SMILES
NCC1CC(F)C1- InChIKey
NEDGZUPNRVBWQP-URHBZAFASA-N- Molecular formula
- C5H10FN
- Average molar mass
- 103.14 g/mol
- Monoisotopic mass
- 103.07972749
Names & identifiers
- Preferred name
- (3-Fluorocyclobutyl)methanamine
- IUPAC
- (3-fluorocyclobutyl)methanamine
- English name
- trans-(3-Fluorocyclobutyl)MethaMine hydrochloride
- Molecular formula
- C5H10FN
- Molecular weight
- 103.14
Names & synonyms
(3-FLUOROCYCLOBUTYL)METHANAMINE1260664-80-9trans-3-Fluorocyclobutyl methanamine1334493-19-4(trans-3-Fluorocyclobutyl)methanamine(cis-3-Fluorocyclobutyl)methanaminecis-(3-Fluorocyclobutyl)methamine1-[(1r,3r)-3-fluorocyclobutyl]methanamineC-(3-FLUORO-CYCLOBUTYL)-METHYLAMINESCHEMBL25247729SCHEMBL26330943DTXSID601270624
Show more names
TRANS-3-FLU0R0CYCL0BUTYL METHANAMINEFLUOROCYCLOBUTYL)METHAMINE HYDROCHLORIDECyclobutanemethanamine, 3-fluoro-, trans-trans-(3-Fluorocyclobutyl)MethaMine hydrochloridetrans-(3-Fluorocyclobutyl)methanamine hydrochloriderel-((1r,3r)-3-fluorocyclobutyl)methanamine hydrochloridetrans-(3-Fluorocyclobutyl)methamine hydrochloride - F11496
cis-(3-fluorocyclobutyl)methanamineMFCD18249867AKOS023599779AKOS025290149PB35344PB36542PB38656[(1r,3r)-3-fluorocyclobutyl]methanamine
Database identifiers
- CAS
1260664-80-9- PubChem CID
- 72207697
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 59.1
Physicochemical properties
- Boiling point
- 123.7 · 123.7±13.0 °C(Predicted)
- Density
- 1 · 1.00±0.1 g/cm3(Predicted)
- storage temp.
- 0 · Store at 0-8 °C
- pka
- 10.27 · 10.27±0.29(Predicted)
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2921309990 · 2921309990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2921309990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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