Basic information
- CAS
33342-28-8- Standard SMILES
OCc1ccc(-c2ccc(Br)cc2)o1- InChIKey
QUJXBDJGUNCYHC-UHFFFAOYSA-N- Molecular formula
- C11H9BrO2
- Average molar mass
- 253.09 g/mol
- Monoisotopic mass
- 251.97859
Names & identifiers
- Preferred name
- 5-(4-Bromophenyl)-2-furanmethanol
- IUPAC
- [5-(4-bromophenyl)furan-2-yl]methanol
- English name
- [5-(4-Bromo-phenyl)-furan-2-yl]-methanol
- Molecular formula
- C11H9BrO2
- Molecular weight
- 253.09
Names & synonyms
33342-28-8RefChem:2998125-(4-Bromophenyl)-2-furanmethanol[5-(4-bromophenyl)-2-furyl]methanol[5-(4-bromophenyl)furan-2-yl]methanol(5-(4-bromophenyl)furan-2-yl)methanol2-Furanmethanol, 5-(4-bromophenyl)-MFCD00691305[5-(4-bromo-phenyl)-furan-2-yl]methanol[5-(4-Bromo-phenyl)-furan-2-yl]-methanolCBMicro_041512Cambridge id 6029974
Show more names
AKOS BB-7849ZINC00118230A3374/0143218ASISCHEM T31179RARECHEM AL BD 0799ART-CHEM-BB B025318
DTXSID20352093ALBB-026767STK049728AKOS000107759LS-09156[5-(4-bromophenyl)-2-furyl]methan-1-olBIM-0041530.P001ST4095336
Database identifiers
- CAS
33342-28-8- PubChem CID
- 718650
- DTXSID
DTXSID20352093
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 33.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 106 · 106-107 °C
- Boiling point
- 352.3 · 352.3±32.0 °C(Predicted)
- Density
- 1.51 · 1.510±0.06 g/cm3(Predicted)
- pka
- 13.88 · 13.88±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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