Basic information
- CAS
28783-37-1- Standard SMILES
NCCc1cc(Br)cs1- InChIKey
PBCITPUKHNCINI-UHFFFAOYSA-N- Molecular formula
- C6H8BrNS
- Average molar mass
- 206.11 g/mol
- Monoisotopic mass
- 204.95608
Names & identifiers
- Preferred name
- 2-(4-Bromothiophen-2-yl)ethan-1-amine
- IUPAC
- 2-(4-bromothiophen-2-yl)ethanamine
- English name
- 2-(4-Bromo-thiophen-2-yl)-ethylamine
- Molecular formula
- C6H8BrNS
- Molecular weight
- 206.1
Names & synonyms
28783-37-12-(4-Bromothiophen-2-yl)ethanamine2-(4-bromothiophen-2-yl)ethan-1-amine2-(4-BROMO-THIOPHEN-2-YL)-ETHYLAMINE4-bromo-2-ThiopheneethanamineSCHEMBL70199DTXSID50567315PBCITPUKHNCINI-UHFFFAOYSA-N2(4-bromo-2-thienyl)-ethylamine2-(4-bromo-2-thienyl)-ethylamine[2-(4-bromo-2-thienyl)ethyl]amineAKOS009260896
Show more names
RARECHEM AN KA 01512-Thiopheneethanamine, 4-bromo-
SB36394DB-067988CS-0266498EN300-1262458
Database identifiers
- CAS
28783-37-1- PubChem CID
- 15036615
- DTXSID
DTXSID50567315
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 89.1
Physicochemical properties
- Boiling point
- 263.3 · 263.3±25.0 °C(Predicted)
- Density
- 1.566 · 1.566±0.06 g/cm3(Predicted)
- pka
- 9.12 · 9.12±0.10(Predicted)
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海智乾生物科技有限公司[email protected]
Related reactions
7 records
Compound notes
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