Basic information
- CAS
31775-97-0- Standard SMILES
O=c1[nH][nH]c2c([N+](=O)[O-])cccc12- InChIKey
DIMKMDUVYPSCLV-UHFFFAOYSA-N- Molecular formula
- C7H5N3O3
- Average molar mass
- 179.13 g/mol
- Monoisotopic mass
- 179.03309103
Names & identifiers
- Preferred name
- 7-Nitro-1,2-dihydroindazol-3-one
- IUPAC
- 7-nitro-1,2-dihydroindazol-3-one
- English name
- 7-NITRO-1,2-DIHYDRO-3H-INDAZOL-3-ON
- Molecular formula
- C7H5N3O3
- Molecular weight
- 179.13
Names & synonyms
31775-97-07-nitro-1,2-dihydroindazol-3-one7-Nitro-1H-indazol-3(2H)-one7-nitro-2,3-dihydro-1H-indazol-3-one7-nitro-1,2-dihydro-3H-indazol-3-oneMFCD062453627-nitro-1H-2-hydroindazol-3-one1,2-Dihydro-7-nitro-3H-indazol-3-oneSCHEMBL3477342SCHEMBL4434075CHEMBL1762741DTXSID00420749
Show more names
7-nitro-indazolin-3-one7-NITRO-1,2-DIHYDRO-3H-INDAZOL-3-ON3H-INDAZOL-3-ONE, 1,2-DIHYDRO-7-NITRO-
DIMKMDUVYPSCLV-UHFFFAOYSA-NSBB018704STK693868AKOS005254227MS-20014ST085621DB-342009F526110
Database identifiers
- CAS
31775-97-0- PubChem CID
- 5708331
- DTXSID
DTXSID00420749- ChEMBL
CHEMBL1762741- Nikkaji
- J2.780.355E、J2.780.357A
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- Hazard Codes
- Xi
- HS Code
- 2933998090 · 2933998090
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
- 2933998090
- hazard_code
- Xi
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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