2-Bromo-5-[(prop-2-en-1-yl)sulfanyl]thiophene
Basic information
- CAS
84021-63-6- Standard SMILES
C=CCSc1ccc(Br)s1- InChIKey
RHWGPPJEJAHDBD-UHFFFAOYSA-N- Molecular formula
- C7H7BrS2
- Average molar mass
- 235.2 g/mol
- Monoisotopic mass
- 233.91726
Names & identifiers
- Preferred name
- 2-Bromo-5-[(prop-2-en-1-yl)sulfanyl]thiophene
- IUPAC
- 2-bromo-5-prop-2-enylsulfanylthiophene
Names & synonyms
84021-63-62-Bromo-5-[(prop-2-en-1-yl)sulfanyl]thiopheneDTXSID30510920
Database identifiers
- CAS
84021-63-6- PubChem CID
- 12828693
- DTXSID
DTXSID30510920
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 116
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Compound notes
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