Basic information
- CAS
1887-60-1- Standard SMILES
Cc1cc2nsnc2cc1C- InChIKey
QQCMLCGOLBUDJF-UHFFFAOYSA-N- Molecular formula
- C8H8N2S
- Average molar mass
- 164.23 g/mol
- Monoisotopic mass
- 164.04081944
Names & identifiers
- Preferred name
- 5,6-Dimethyl-2,1,3-benzothiadiazole
- IUPAC
- 5,6-dimethyl-2,1,3-benzothiadiazole
- English name
- 5,6-Dimethylbenzo-2,1,3-thiadiazole
- Molecular formula
- C8H8N2S
- Molecular weight
- 164.23
Names & synonyms
1887-60-15,6-dimethyl-2,1,3-benzothiadiazoleDTXSID00351084RefChem:298711DTXCID403021515,6-Dimethylbenzo-2,1,3-thiadiazole5,6-Dimethylbenzo[c][1,2,5]thiadiazoleMFCD00174277Maybridge1_006083SCHEMBL367773HMS558M11STK743031
Show more names
5,6-Dimethylpiazthiole2,1,3-Benzothiadiazole, 5,6-dimethyl-
AKOS0005413615,6-dimethylbenzo[c]1,2,5-thiadiazoleAS-63434DB-015081ST4017590CS-0324094SR-01000511600SR-01000511600-1
Database identifiers
- CAS
1887-60-1- PubChem CID
- 690255
- DTXSID
DTXSID00351084- EC Number
- 681-619-9
- Nikkaji
- J150.937C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- Melting point
- 89 °C · 89 °C
- Boiling point
- 262 · 262-263 °C
- Density
- 1.243 · 1.243±0.06 g/cm3(Predicted)
- pka
- 1.13 · 1.13±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- risk_code
- 36/37/38
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers22 total
杭州奥得科技有限公司0571-88772972-0 15057128248 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
河南伊诺凯新材料有限公司13290191024 13290191024 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
苏州明石新科生物科技有限公司13914069417 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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