Basic information
- CAS
57543-87-0- Standard SMILES
COc1cccc2c1OC(c1ccccc1)C([N+](=O)[O-])=C2- InChIKey
VZZMTGKGLHHYIS-UHFFFAOYSA-N- Molecular formula
- C16H13NO4
- Average molar mass
- 283.28 g/mol
- Monoisotopic mass
- 283.0844579
Names & identifiers
- Preferred name
- 8-Methoxy-3-nitro-2-phenyl-2H-1-benzopyran
- IUPAC
- 8-methoxy-3-nitro-2-phenyl-2H-chromene
- English name
- 8-Methoxy-3-nitro-2-phenyl-2H-1-benzopyran
- Molecular formula
- C16H13NO4
- Molecular weight
- 283.28
Names & synonyms
8-Methoxy-3-nitro-2-phenyl-2H-1-benzopyran8-methoxy-3-nitro-2-phenyl-2H-chromene57543-87-02H-1-BENZOPYRAN, 8-METHOXY-3-NITRO-2-PHENYL-BRN 1435081Oprea1_765169DTXSID10973110VZZMTGKGLHHYIS-UHFFFAOYSA-NSTK764987AKOS001748710AKOS022015112ST075714
Show more names
DB-296895EU-0019356AG-205/13901035SR-01000533588Methyl 3-nitro-2-phenyl-2H-chromen-8-yl ether #SR-01000533588-1
Database identifiers
- CAS
57543-87-0- PubChem CID
- 42453
- DTXSID
DTXSID10973110- Nikkaji
- J132.093I
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 411
Chemistry & industry
Suppliers1 total
上海波以尔化工有限公司021-50182298 021-50180596 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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