2-Acetylaminocarbazole
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Basic information
- CAS
63020-20-2- Standard SMILES
CC(=O)Nc1ccc2c(c1)[nH]c1ccccc12- InChIKey
QYMUFCDNSROFHA-UHFFFAOYSA-N- Molecular formula
- C14H12N2O
- Average molar mass
- 224.26 g/mol
- Monoisotopic mass
- 224.09496301
Names & identifiers
- Preferred name
- 2-Acetylaminocarbazole
- IUPAC
- N-(9H-carbazol-2-yl)acetamide
- English name
- 2-ACETYLAMINOCARBAZOLE
- Molecular formula
- C14H12N2O
- Molecular weight
- 224.26
Names & synonyms
2-AcetylaminocarbazoleN-9H-Carbazol-2-ylacetamide63020-20-2CHEMBL63669n-(9h-carbazol-2-yl)acetamideCCRIS 6505Acetamide, N-9H-carbazol-2-yl-BRN 0384208N-2-CarbazolylacetamideAUS783HB9FAcetamide, N-2-carbazolyl-4-22-00-04934 (Beilstein Handbook Reference)
Show more names
NIOSH/AB5004910SCHEMBL22616930DTXSID20877418N-(9H-Carbazol-2-yl)-acetamideBDBM50038944DB-313495AB50049100
Database identifiers
- CAS
63020-20-2- PubChem CID
- 112980
- DTXSID
DTXSID20877418- ChEMBL
CHEMBL63669- UNII
- AUS783HB9F
- Nikkaji
- J524.453F
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 305
Experimental & physicochemical properties
LogP3.02
Physicochemical properties
- Melting point
- 237 · 237-238 °C
- Boiling point
- 534.8 · 534.8±23.0 °C(Predicted)
- Density
- 1.326 · 1.326±0.06 g/cm3(Predicted)
- pka
- 15.67 · 15.67±0.43(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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