Introduction:Basic information about CAS 130-17-6|2-(4-Aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(4-Aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid |
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| CAS Number | 130-17-6 | Molecular Weight | 320.38700 |
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| Density | 1.505 g/cm3 | Boiling Point | / |
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| Molecular Formula | C14H12N2O3S2 | Melting Point | 300 °C |
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| MSDS | / | Flash Point | / |
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Names
| Name | 2-(4-Aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.505 g/cm3 |
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| Melting Point | 300 °C |
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| Molecular Formula | C14H12N2O3S2 |
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| Molecular Weight | 320.38700 |
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| Exact Mass | 320.02900 |
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| PSA | 129.90000 |
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| LogP | 4.76260 |
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| Index of Refraction | 1.714 |
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| InChIKey | KGZUHYIHYBDNLC-UHFFFAOYSA-N |
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| SMILES | Cc1ccc2nc(-c3ccc(N)cc3)sc2c1S(=O)(=O)O |
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| Water Solubility | <0.1 g/100 mL at 22 ºC |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DL6420000
- CHEMICAL NAME :
- 7-Benzothiazolesulfonic acid, 2-(p-aminophenyl)-6-methyl-
- CAS REGISTRY NUMBER :
- 130-17-6
- BEILSTEIN REFERENCE NO. :
- 0313390
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C14-H12-N2-O3-S2
- MOLECULAR WEIGHT :
- 320.40
- WISWESSER LINE NOTATION :
- T56 BN DSJ CR DZ& FSWQ G1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 178 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00718 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X3920 No. of Facilities: 25 (estimated) No. of Industries: 1 No. of Occupations: 4 No. of Employees: 1450 (estimated)
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Safety Information
| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R20/21/22;R36/37/38 |
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| Safety Phrases | S26-S36/37/39 |
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| HS Code | 2934999090 |
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Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 2-(4-Aminophenyl)-6-methyl-7-benzothiazole sulfonic acid |
| p-(6-Methyl-7-sulfobenzothiazole)aniline |
| EINECS 204-979-7 |
| 2-(p-Aminophenyl)-6-methyl-7-benzothiazolesulfonic acid |
| 2-(4'-aminophenyl)-6-methylbenzothiazole-7-sulphonic acid |
| 2-(4-Aminophenyl)-6-methylbenzothiazole sulfonic acid |
| MFCD00043906 |
| 2-(4-Aminophenyl)-6-methylbenzothiazole-7-sulphonic acid |
| 2-(4-aminophenyl)-6-methylbenzo[d]thiazole-7-sulfonic acid |
| 2-(p-aminophenyl)-6-methylbenzothiazole-7-sulfonic acid |
| Dehydrothio-p-toluidinesulfonic acid |
| 2-(4-amino-phenyl)-6-methyl-benzothiazole-7-sulfonic acid |