Cas no 2942-07-6 (5-nitro-1,3-benzothiazole)
5-nitro-1,3-benzothiazole structure
Product Name:5-nitro-1,3-benzothiazole
CAS No:2942-07-6
MF:C7H4N2O2S
MW:180.183859825134
MDL:MFCD00085891
CID:275879
PubChem ID:350135
Update Time:2025-09-27
5-nitro-1,3-benzothiazole Chemical and Physical Properties
Names and Identifiers
-
- 5-Nitrobenzothiazole
- 5-Nitro-1,3-benzothiazole
- 5-nitrobenzo[d]isothiazole
- 5-Nitrobenzo[d]thiazole
- 5-Nitro-benzothiazole
- 5-Nitro-benzothiazol
- 5-Nitro-benzthiazol
- benzothiazole,5-nitro
- F9995-0185
- NSC-507466
- 1,3-Benzothiazole, 5-Nitro
- DTXSID40325441
- SCHEMBL1011755
- AS-5527
- DS-0412
- NSC507466
- benzothiazole, 5-nitro-
- AKOS006220663
- A819905
- CS-W008286
- EN300-42152
- 2942-07-6
- InChI=1/C7H4N2O2S/c10-9(11)5-1-2-7-6(3-5)8-4-12-7/h1-4
- 5-Nitro-1,3-benzothiazole #
- SY104420
- SB36423
- MFCD00085891
- FT-0649760
- AM20050426
- 5-nitro-1,3-benzothiazole;Benzothiazole, 5-nitro- (6CI,7CI,8CI,9CI);
- DB-029184
- 5-nitro-1,3-benzothiazole
-
- MDL： MFCD00085891
- Inchi： 1S/C7H4N2O2S/c10-9(11)5-1-2-7-6(3-5)8-4-12-7/h1-4H
- InChI Key： AEUQLELVLDMMKB-UHFFFAOYSA-N
- SMILES： S1C=NC2C=C(C=CC1=2)[N+](=O)[O-]
Computed Properties
- Exact Mass: 179.99900
- Monoisotopic Mass: 179.99934855g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 194
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 87?2
Experimental Properties
- Density: 1.525±0.06 g/cm3 (20 oC 760 Torr),
- Melting Point: 163-164 oC
- Boiling Point: 333.7°C at 760 mmHg
- Solubility: Slightly soluble (14 g/l) (25 o C),
- PSA: 86.95000
- LogP: 2.72770
5-nitro-1,3-benzothiazole Security Information
- Signal Word：Warning
- Hazard Statement： H315-H319-H335
- Warning Statement： P261-P305+P351+P338
- HazardClass：IRRITANT
- Storage Condition：Sealed in dry,2-8°C
5-nitro-1,3-benzothiazole Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
5-nitro-1,3-benzothiazole Pricemore >>
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