Mls002608685
Basic information
- CAS
22359-44-0- Standard SMILES
O=C1C(Cl)=C(NCc2ccco2)C(=O)c2ccccc21- InChIKey
HUQAZTJPZNRJDY-UHFFFAOYSA-N- Molecular formula
- C15H10ClNO3
- Average molar mass
- 287.7 g/mol
- Monoisotopic mass
- 287.0349209
Names & identifiers
- Preferred name
- Mls002608685
- IUPAC
- 2-chloro-3-(furan-2-ylmethylamino)naphthalene-1,4-dione
Names & synonyms
MLS00260868522359-44-0DTXSID10286353RefChem:357147DTXCID702375032-chloro-3-[(furan-2-ylmethyl)amino]naphthalene-1,4-dione2-chloro-3-((furan-2-ylmethyl)amino)naphthalene-1,4-dioneNSC45029BAS 032001151, 2-chloro-3-furfurylamino-CHEMBL1708891HMS3078I06
Show more names
NSC-45029STK710696AKOS000596478ST50339558SR-01000323412SR-01000323412-12-Chloro-3-{[(furan-2-yl)methyl]amino}naphthalene-1,4-dione
Database identifiers
- CAS
22359-44-0- PubChem CID
- 239677
- DTXSID
DTXSID10286353- ChEMBL
CHEMBL1708891
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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