Basic information
- Standard SMILES
CC(=O)n1ncc2ccc(I)cc21- InChIKey
HOGDXBAVSPDNDJ-UHFFFAOYSA-N- Molecular formula
- C9H7IN2O
- Average molar mass
- 286.07 g/mol
Names & identifiers
- Preferred name
- 1-(6-Iodo-1H-indazol-1-yl)ethanone
- IUPAC
- 1-(6-iodoindazol-1-yl)ethanone
- English name
- 1-(6-iodo-1H-indazol-1-yl)ethanone
- Molecular formula
- C9H7IN2O
- Molecular weight
- 286.07
Names & synonyms
1-(6-Iodo-1H-indazol-1-yl)ethanone850363-52-91-(6-iodo-1H-indazol-1-yl)ethan-1-oneSCHEMBL1141640DB-088086F131741-(6-Iodo-indazol-1-yl)-ethanoneEthanone, 1-(6-iodo-1H-indazol-1-yl)-1-Acetyl-6-iodo-1H-indazoleQ: What is 1-Acetyl-6-iodo-1H-indazole Q: What is the CAS Number of 1-Acetyl-6-iodo-1H-indazole
Database identifiers
- CAS
850363-52-9
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Boiling point
- 386.8 · 386.8±34.0 °C(Predicted)
- Density
- 1.9 · 1.90±0.1 g/cm3(Predicted)
- pka
- -2.46 · -2.46±0.30(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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