Basic information
- CAS
374554-75-3- Standard SMILES
Clc1cc(-c2cccs2)ncn1- InChIKey
WISVYBFTUYSGNO-UHFFFAOYSA-N- Molecular formula
- C8H5ClN2S
- Average molar mass
- 196.66 g/mol
- Monoisotopic mass
- 195.986197
Names & identifiers
- Preferred name
- 4-Chloro-6-(thiophen-2-yl)pyrimidine
- IUPAC
- 4-chloro-6-thiophen-2-ylpyrimidine
- English name
- 4-Chloro-6-thiophen-2-yl-pyrimidine
- Molecular formula
- C8H5ClN2S
- Molecular weight
- 196.66
Names & synonyms
4-chloro-6-(thiophen-2-yl)pyrimidine374554-75-3RefChem:521569816-513-54-chloro-6-(2-thienyl)pyrimidine4-chloro-6-thiophen-2-ylpyrimidine4-Chloro-6-thiophen-2-yl-pyrimidineSCHEMBL1445236WISVYBFTUYSGNO-UHFFFAOYSA-NZPA55475AKOS005208331EN300-238638
Show more names
Pyrimidine, 4-chloro-6-(2-thienyl)-
G54386F495056F1967-0503Z1198234906
Database identifiers
- CAS
374554-75-3- PubChem CID
- 24902111
- EC Number
- 816-513-5
- Nikkaji
- J2.531.717C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
6 records
Compound notes
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