Basic information
- CAS
73351-87-8- Standard SMILES
Cc1cc(C)c2sc(N)nc2c1- InChIKey
AKPWHGBCJISNKZ-UHFFFAOYSA-N- Molecular formula
- C9H10N2S
- Average molar mass
- 178.26 g/mol
- Monoisotopic mass
- 178.05646932
Names & identifiers
- Preferred name
- 5,7-Dimethyl-1,3-benzothiazol-2-amine
- IUPAC
- 5,7-dimethyl-1,3-benzothiazol-2-amine
- English name
- 2-Benzothiazolamine,5,7-dimethyl-(9CI)
- Molecular formula
- C9H10N2S
- Molecular weight
- 178.25
Names & synonyms
5,7-dimethyl-1,3-benzothiazol-2-amine73351-87-8DTXSID10365975RefChem:298872DTXCID103170155,7-dimethylbenzo[d]thiazol-2-amine5,7-Dimethyl-benzothiazol-2-ylamineMFCD044488255,7-dimethyl-1,3-benzothiazol-2-ylamineF1911-00285,7-dimethyl-2-Benzothiazolamine2-Amino-5,7-dimethylbenzothiazole
Show more names
2-BenzothiazolaMine, 5,7-diMethyl-5,7-Dimethylbenzothiazol-2-ylamine5,7-Dimethylbenzo[d]thiazol-2-amine, 97%
2-Benzothiazolamine,5,7-dimethyl-(9CI)MLS000678445CHEMBL1479891SCHEMBL10991202SCHEMBL30944287AKPWHGBCJISNKZ-UHFFFAOYSA-NHMS2725N16SMSSF-0426740
Database identifiers
- CAS
73351-87-8- PubChem CID
- 2049896
- DTXSID
DTXSID10365975- ChEMBL
CHEMBL1479891- EC Number
- 141-374-6
- Nikkaji
- J3.101.297J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Experimental & physicochemical properties
Solubility25.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2934208090 · 2934208090
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934208090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers13 total
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
北京伊诺凯科技有限公司15652467323 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
格莱斯兰德（天津）医药科技有限公司022-83705301 13752403750
南京凯姆铂医药科技有限公司025-66162170
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
江西元兴生物医药科技有限公司13642377995 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
重庆卡兰医药有限公司[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]
Richest Group Ltd18017061086 · [email protected]
Related reactions
2 records
Compound notes
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