Basic information
- CAS
1204298-68-9- Standard SMILES
CSc1nc(Cl)cc(C(F)F)n1- InChIKey
IHRHHFIDUYHBOD-UHFFFAOYSA-N- Molecular formula
- C6H5ClF2N2S
- Average molar mass
- 210.63 g/mol
- Monoisotopic mass
- 209.98300328
Names & identifiers
- Preferred name
- 4-Chloro-6-(difluoromethyl)-2-(methylthio)pyrimidine
- IUPAC
- 4-chloro-6-(difluoromethyl)-2-methylsulfanylpyrimidine
- English name
- 4-Chloro-6-(difluoromethyl)-2-(methylthio)pyrimidine
- Molecular formula
- C6H5ClF2N2S
- Molecular weight
- 210.63
Names & synonyms
4-CHLORO-6-(DIFLUOROMETHYL)-2-(METHYLTHIO)PYRIMIDINE1204298-68-9MFCD128277204-Chloro-6-(difluoromethyl)-2-(methylsulfanyl)pyrimidine4-chloro-6-(difluoromethyl)-2-methylsulfanylpyrimidineC6H5ClF2N2SSCHEMBL16044834DTXSID30719870EYB29868AS-92946SY198359DB-094818
Show more names
Pyrimidine, 4-chloro-6-(difluoromethyl)-2-(methylthio)-
EN300-216414G693494-chloro-6-(difluoromethyl)-2-methylsulfanyl-pyrimidineZ1269214439
Database identifiers
- CAS
1204298-68-9- PubChem CID
- 56972980
- DTXSID
DTXSID30719870- EC Number
- 113-540-8
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 150
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, 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%)
Chemistry & industry
Suppliers18 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海源鼎化学科技有限公司21-57721279 18121011378 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
南京伊派森化学科技有限公司025-58786926 18951781718 · [email protected]
南通开盛生物科技有限公司13951303301;13951303301 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Changzhou Exploring Chemical Co., Ltd15295164949 · [email protected]
上海康恩博医药科技有限公司17510465506 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
1 records
Compound notes
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