Basic information
- CAS
21859-87-0- Standard SMILES
Nc1ccccc1C(=O)N1CCc2ccccc21- InChIKey
WBIVLKJODIOWTB-UHFFFAOYSA-N- Molecular formula
- C15H14N2O
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.11061307
Names & identifiers
- Preferred name
- (2-Aminophenyl)(indolin-1-yl)methanone
- IUPAC
- (2-aminophenyl)-(2,3-dihydroindol-1-yl)methanone
- English name
- Methanone, (2-aminophenyl)(2,3-dihydro-1H-indol-1-yl)-
- Molecular formula
- C15H14N2O
- Molecular weight
- 238.28
Names & synonyms
(2-Aminophenyl)(indolin-1-yl)methanone21859-87-0DTXSID50341970RefChem:205772DTXCID402930501-(2-Aminobenzoyl)indoline(2-aminophenyl)-(2,3-dihydroindol-1-yl)methanoneMFCD00955303(2-aminophenyl)(2,3-dihydro-1H-indol-1-yl)methanone2-(2,3-dihydro-1H-indole-1-carbonyl)aniline2-aminophenyl indolinyl ketoneMethanone, (2-aminophenyl)(2,3-dihydro-1H-indol-1-yl)-
Show more names
1-Anthraniloylindoline1-(2-Aminobenzoyl)-2,3-dihydro-1H-indole
Oprea1_025799MLS001213098(2-Amino-phenyl)-(2,3-dihydro-indol-1-yl)-methanoneCHEMBL1583231WBIVLKJODIOWTB-UHFFFAOYSA-NHMS2834H11SBB055986STK098762
Database identifiers
- CAS
21859-87-0- PubChem CID
- 577461
- DTXSID
DTXSID50341970- ChEMBL
CHEMBL1583231
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 318
Experimental & physicochemical properties
Solubility>35.7 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 442.4 · 442.4±45.0 °C(Predicted)
- Density
- 1.261 · 1.261
- pka
- 0.79 · 0.79±0.10(Predicted)
- HS Code
- 2921490090 · 2921490090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2921490090
Chemistry & industry
Suppliers5 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉罗化科技有限公司13477084141; 13477084141 · [email protected]
无锡中坤生化科技有限公司+86 0510-85629785
雷丁试剂0510-85629785 18013409632 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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