Basic information
- CAS
207-87-4- Standard SMILES
c1ccc2c(c1)ccc1[nH]c3c(ccc4cccnc43)c12- InChIKey
SRFZWNXMRFIYRW-UHFFFAOYSA-N- Molecular formula
- C19H12N2
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.10004839
Names & identifiers
- Preferred name
- 13H-Benzo(g)pyrido(2,3-a)carbazole
- IUPAC
- 12,15-diazapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene
- English name
- 11H-Benzo[g]pyrido[2,3-a]carbazole
- Molecular formula
- C19H12N2
- Molecular weight
- 268.31
Names & synonyms
13H-Benzo(g)pyrido(2,3-a)carbazole207-87-413H-Benzo[g]pyrido[2,3-a]carbazole13H-(Benzo(g)pyrido(2,3-a))carbazole5,6-Benzopyrido(2',3':1,2)carbazoleSCHEMBL22762131DTXSID10942902207-88-511H-Benzo[g]pyrido[2,3-a]carbazole
Database identifiers
- CAS
207-87-4、207-88-5- PubChem CID
- 67464
- DTXSID
DTXSID10942902
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 395
Physicochemical properties
- Boiling point
- 401.48 °C · 401.48°C (rough estimate)
- Density
- 1.0218 · 1.0218 (rough estimate)
- refractive index
- 1.8676 · 1.8676 (estimate)
- pka
- 4.32 · 4.32±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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