4-Bromo-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-thione
Basic information
- CAS
7504-52-1- Standard SMILES
COc1c2occc2c(Br)c2ccc(=S)oc12- InChIKey
AEZLFBLGIDIOSO-UHFFFAOYSA-N- Molecular formula
- C12H7BrO3S
- Average molar mass
- 311.15 g/mol
- Monoisotopic mass
- 309.92993
Names & identifiers
- Preferred name
- 4-Bromo-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-thione
- IUPAC
- 4-bromo-9-methoxyfuro[3,2-g]chromene-7-thione
Names & synonyms
NSC4012747504-52-14-Bromo-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-thioneDTXSID40322455NSC-4012744-bromo-9-methoxy-furo[3,2-g]chromene-7-thione4-Bromo-9-methoxy-7H-furo[3,2-g]chromene-7-thione
Database identifiers
- CAS
7504-52-1- PubChem CID
- 344394
- DTXSID
DTXSID40322455
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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