6-chloro-2-imino-2H-chromene-3-carboxamide
Basic information
- CAS
67231-52-1- Standard SMILES
N=c1oc2ccc(Cl)cc2cc1C(N)=O- InChIKey
CEYNZSGQXWUTGS-UHFFFAOYSA-N- Molecular formula
- C10H7ClN2O2
- Average molar mass
- 222.63 g/mol
- Monoisotopic mass
- 222.0196052
Names & identifiers
- Preferred name
- 6-chloro-2-imino-2H-chromene-3-carboxamide
- IUPAC
- 6-chloro-2-iminochromene-3-carboxamide
Names & synonyms
6-chloro-2-imino-2H-chromene-3-carboxamide67231-52-1DTXSID90327915RefChem:307845DTXCID902790262H-1-Benzopyran-3-carboxamide, 6-chloro-2-imino-6-chloro-2-iminochromene-3-carboxamideNSC7010726-Chloro-2-imino-2H-1-benzopyran-3-carboxamideOprea1_785016CHEMBL1966358HMS1649O13
Show more names
STK075510AKOS005391186NSC-701072NCI60_036322AE-848/10303045SR-01000004915SR-01000004915-1F0110-0171
Database identifiers
- CAS
67231-52-1- PubChem CID
- 395948
- DTXSID
DTXSID90327915- ChEMBL
CHEMBL1966358- Nikkaji
- J940.666B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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