Naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acid
Basic information
- CAS
117-70-4- Standard SMILES
O=S(=O)(O)c1cc2nnoc2c2ccccc12- InChIKey
OIDKWKZBMQUGNQ-UHFFFAOYSA-N- Molecular formula
- C10H6N2O4S
- Average molar mass
- 250.23 g/mol
- Monoisotopic mass
- 250.00482785
Names & identifiers
- Preferred name
- Naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acid
- IUPAC
- benzo[g][1,2,3]benzoxadiazole-5-sulfonic acid
- English name
- naphth[2,1-d]-1,2,3-oxadiazole-5-sulphonic acid
- Molecular formula
- C10H6N2O4S
- Molecular weight
- 250.23
Names & synonyms
117-70-4naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acidEINECS 204-204-2Naphth(2,1-d)-1,2,3-oxadiazole-5-sulfonic acidDTXSID9059460RefChem:164559DTXCID1033406benzo[g][1,2,3]benzoxadiazole-5-sulfonic acidnaphth[2,1-d]-1,2,3-oxadiazole-5-sulphonic acidNaphth(2,1-d)-1,2,3-oxadiazole-5-sulphonic acidNKG9G35ATNSCHEMBL5516755
Show more names
NAPHTHO[2,1-D][1,2,3]OXADIAZOLE-5-SULFONIC ACIDOIDKWKZBMQUGNQ-UHFFFAOYSA-NNS00041460
Database identifiers
- CAS
117-70-4- PubChem CID
- 67027
- DTXSID
DTXSID9059460- UNII
- NKG9G35ATN
- EC Number
- 204-204-2
- Nikkaji
- J193.621B
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 394
Physicochemical properties
- EPA Substance Registry System
- 2 · Naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acid (117-70-4)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNaphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acid: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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