Basic information
- CAS
18631-22-6- Standard SMILES
O=C1c2ccccc2-c2cnccc21- InChIKey
FVUGGEIGQCQEBB-UHFFFAOYSA-N- Molecular formula
- C12H7NO
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.05276385
Names & identifiers
- Preferred name
- 5H-Indeno(1,2-c)pyridin-5-one
- IUPAC
- indeno[1,2-c]pyridin-5-one
- English name
- 5H-Indeno[1,2-c]pyridin-5-one
- Molecular formula
- C12H7NO
- Molecular weight
- 181.19
Names & synonyms
5H-indeno[1,2-c]pyridin-5-one18631-22-65H-INDENO(1,2-c)PYRIDIN-5-ONE5-Chetoindeno(1,2-c)piridazina5-Chetoindeno(1,2-c)piridazina [Italian]DTXSID50171875RefChem:103575DTXCID0094366indeno[1,2-c]pyridin-5-oneMFCD007570123-azafluore-noneSCHEMBL3066734
Show more names
3-Azafluorenone3-Azafluoren-9-one3-Azafluorene-9-one
AC2076AKOS027256905CS-12073SY0368555H-Indeno[1,2-c]pyridin-5-one;3-Azafluorene-9-one
Database identifiers
- CAS
18631-22-6- PubChem CID
- 29159
- DTXSID
DTXSID50171875- Nikkaji
- J82.785A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Melting point
- 129 · 129-130℃
- Boiling point
- 361 · 361.0±11.0 °C(Predicted)
- Density
- 1.312 · 1.312±0.06 g/cm3(Predicted)
- pka
- 2.27 · 2.27±0.20(Predicted)
- InChI
- InChI=1S/C12H7NO/c14-12-9-4-2-1-3-8(9)11-7-13-6-5-10(11)12/h1-7H
- InChIKey
- FVUGGEIGQCQEBB-UHFFFAOYSA-N
- SMILES
- C1=NC=CC2C(=O)C3=C(C1=2)C=CC=C3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses5H-indo[1,2-C]pyridin-5-one is mainly used in laboratory organic synthesis and in chemical and pharmaceutical research and development.
Suppliers14 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
重庆福腾医药有限公司18696571988 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
郑州阿尔法化工有限公司0371-53765687 18937137882 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
郑州艾克姆化工有限公司0371-0371-55629727 13323845623 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
河南拉瓦锡化工产品有限公司0371-63682289 18625781376 · [email protected]
湖北拓邦化工有限公司027-59106185 13986192185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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