4-Bromobutan-1-amine
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Basic information
- CAS
33977-38-7- Standard SMILES
NCCCCBr- InChIKey
MVZBYZAIKPPGSW-UHFFFAOYSA-N- Molecular formula
- C4H10BrN
- Average molar mass
- 152.03 g/mol
- Monoisotopic mass
- 150.99966
Names & identifiers
- Preferred name
- 4-Bromobutan-1-amine
- IUPAC
- 4-bromobutan-1-amine
- English name
- 4-bromobutan-1-amine
- Molecular formula
- C4H10BrN
- Molecular weight
- 152.03
Names & synonyms
4-bromobutan-1-amine33977-38-7DTXSID10329113RefChem:291105DTXCID10280215bromobutyl amineNCIOpen2_005640SCHEMBL294722SCHEMBL294723AKOS006294528DA-21372EN300-86463
Show more names
4-bromo-1-Butanamine1-Butanamine, 4-bromo-
Database identifiers
- CAS
33977-38-7- PubChem CID
- 417465
- DTXSID
DTXSID10329113- Nikkaji
- J1.495.292F
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 23.5
Physicochemical properties
- Boiling point
- 57 °C · 57 °C(Press: 13 Torr)
- Density
- 1.364 · 1.364±0.06 g/cm3(Predicted)
- pka
- 10.04 · 10.04±0.10(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301+H311+H331-H314
- Precautionary statements
- 261 · P261-P280-P305+P351+P338-P310
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
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H301+H311+H331-H314
- Precautionary statements
- P261-P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
2 records
Compound notes
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