3H-Naphtho[2,1-b]pyran-2-carboxamide, 3-imino-
Basic information
- CAS
24759-88-4- Standard SMILES
N=c1oc2ccc3ccccc3c2cc1C(N)=O- InChIKey
VNHCIICJCYBUKX-UHFFFAOYSA-N- Molecular formula
- C14H10N2O2
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.07422757
Names & identifiers
- Preferred name
- 3H-Naphtho[2,1-b]pyran-2-carboxamide, 3-imino-
- IUPAC
- 3-iminobenzo[f]chromene-2-carboxamide
- English name
- 3H-Naphtho[2,1-b]pyran-2-carboxamide, 3-imino-
- Molecular formula
- C14H10N2O2
- Molecular weight
- 238.24
Names & synonyms
24759-88-43H-Naphtho[2,1-b]pyran-2-carboxamide, 3-imino-3-iminobenzo[f]chromene-2-carboxamide3-IMINO-3H-BENZO(F)CHROMENE-2-CARBOXAMIDE3-IMINO-3H-BENZO[F]CHROMENE-2-CARBOXAMIDENSC701070Oprea1_078266CHEMBL1992666DTXSID30327914AKOS024343811NSC-701070NCI60_036320
Show more names
ST505629163-Imino-3H-naphtho[2,1-b]pyran-2-carboxamideAE-848/32605031
Database identifiers
- CAS
24759-88-4- PubChem CID
- 395946
- DTXSID
DTXSID30327914- ChEMBL
CHEMBL1992666
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 416
Physicochemical properties
- Melting point
- 299 °C · 299 °C(Solv: acetonitrile (75-05-8))
- Boiling point
- 493.5 · 493.5±55.0 °C(Predicted)
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- pka
- 13.58 · 13.58±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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