Basic information
- CAS
14346-19-1- Standard SMILES
Nc1snc2ccc([N+](=O)[O-])cc12- InChIKey
SQBCSDZTDXLTLE-UHFFFAOYSA-N- Molecular formula
- C7H5N3O2S
- Average molar mass
- 195.2 g/mol
- Monoisotopic mass
- 195.01024758
Names & identifiers
- Preferred name
- 2,1-Benzisothiazol-3-amine, 5-nitro-
- IUPAC
- 5-nitro-2,1-benzothiazol-3-amine
- English name
- 3-Amino-5-nitro-2,1-benzisothiazole
- Molecular formula
- C7H5N3O2S
- Molecular weight
- 195.2
Names & synonyms
14346-19-15-Nitro-2,1-benzisothiazol-3-amine2,1-Benzisothiazol-3-amine, 5-nitro-EINECS 238-298-1CCRIS 8332DTXSID7065756RefChem:439936DTXCID7034674238-298-15-nitrobenzo[c]isothiazol-3-amine5-nitro-2,1-benzothiazol-3-amine3-Amino-5-nitro-2,1-benzisothiazole
Show more names
3-Amino-5-nitrobenzoisoxazole3-AMINO-5-NITRO BENZISOLTHIAZOLE5-nitro-1-benzisothiazol-3-amine3-amino-5-nitrophenylpropanthiazole
3-Amino-5-nitrobenz[c]isothiazoleQE8JYN5ZP9SCHEMBL2964632AKOS005198449FA147021CS-0232865NS000246635-Nitro-1,3-dihydrobenzo[c]isothiazol-3-amine
Database identifiers
- CAS
14346-19-1- PubChem CID
- 84367
- DTXSID
DTXSID7065756- UNII
- QE8JYN5ZP9
- EC Number
- 238-298-1
- Nikkaji
- J216.975D
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- Melting point
- 250 ℃ · 250℃ (dec.)
- Boiling point
- 418.8 · 418.8±25.0 °C(Predicted)
- Density
- 1.621 · 1.621±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 6.54 · 6.54±0.50(Predicted)
- CAS DataBase Reference
- 14346 · 14346-19-1(CAS DataBase Reference)
- EPA Substance Registry System
- 2 · 2,1-Benzisothiazol-3-amine, 5-nitro- (14346-19-1)
- 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 Information2,1-Benzisothiazol-3-amine, 5-nitro-: ACTIVE
Applications
Uses3-AMINO-5-NITRO-2,1-BENZISOTHIAZOLE is used as an intermediate for disperse dyes.
Upstream & downstream products
Downstream products
Suppliers58 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
河北永泰供应链管理有限公司15130657697 15130657697 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州景优化工有限公司87211835 13957193240 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
湖北云镁科技有限公司
Related reactions
1 records
Compound notes
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