Basic information
- CAS
333961-98-1- Standard SMILES
C=C(Br)CCC1OCCO1- InChIKey
COJQNROBPRUOQA-UHFFFAOYSA-N- Molecular formula
- C7H11BrO2
- Average molar mass
- 207.06 g/mol
- Monoisotopic mass
- 205.99424
Names & identifiers
- Preferred name
- 2-(3-Bromo-but-3-enyl)-[1,3]dioxolane
- IUPAC
- 2-(3-bromobut-3-enyl)-1,3-dioxolane
- English name
- 2-(3-Bromo-but-3-enyl)-[1,3]dioxolane
- Molecular formula
- C7H11BrO2
- Molecular weight
- 207.06504
Names & synonyms
333961-98-12-(3-BROMO-BUT-3-ENYL)-[1,3]DIOXOLANE2-(3-BROMOBUT-3-EN-1-YL)-1,3-DIOXOLANEDTXSID40338955COJQNROBPRUOQA-UHFFFAOYSA-NAKOS0159630152-(3-Bromo-3-butenyl)-1,3-dioxolane #1,3-Dioxolane, 2-(3-bromo-3-buten-1-yl)-
Database identifiers
- CAS
333961-98-1- PubChem CID
- 552140
- DTXSID
DTXSID40338955- Nikkaji
- J2.168.972F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 119
Chemistry & industry
Suppliers4 total
APAC Pharmaceutical, LLC[email protected]
Leancare Ltd.[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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