Basic information
- CAS
885519-43-7- Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c2c(I)[nH]nc2c1- InChIKey
OULGATRUCQEWNW-UHFFFAOYSA-N- Molecular formula
- C7H3IN4O4
- Average molar mass
- 334.03 g/mol
- Monoisotopic mass
- 333.9199
Names & identifiers
- Preferred name
- 3-Iodo-4,6-dinitro-1H-indazole
- IUPAC
- 3-iodo-4,6-dinitro-2H-indazole
- English name
- 4,6-Dinitro-3-iodoindazole
- Molecular formula
- C7H3IN4O4
- Molecular weight
- 334.03
Names & synonyms
3-Iodo-4,6-dinitro-1H-indazole885519-43-73-iodo-4,6-dinitro-2H-indazoleDTXSID40646188AKOS016004297DB-3313514,6-Dinitro-3-iodoindazole1H-Indazole, 3-iodo-4,6-dinitro-
Database identifiers
- CAS
885519-43-7- PubChem CID
- 24728124
- DTXSID
DTXSID40646188
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 316
Chemistry & industry
Suppliers3 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉代为医药科技有限公司027-65318838 13646286950 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…