Basic information
- CAS
315710-85-1- Standard SMILES
Cc1cc(C(=O)CCl)c(C)n1-c1cccc(F)c1- InChIKey
UMSNWZWJTFGFSJ-UHFFFAOYSA-N- Molecular formula
- C14H13ClFNO
- Average molar mass
- 265.71 g/mol
- Monoisotopic mass
- 265.0669699
Names & identifiers
- Preferred name
- 2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
- IUPAC
- 2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone
- English name
- 2-Chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
- Molecular formula
- C14H13ClFNO
- Molecular weight
- 265.71
Names & synonyms
315710-85-12-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone2-Chloro-1-(1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethanoneMFCD023303812-chloro-1-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-oneF1143-4021DTXSID20351622AKOS000343494SB62212AS-17969ST50051031
Show more names
Ethanone, 2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-chloro-1-(1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one
EN300-10146F217347Z568843762-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethyl-1h-pyrrol-3-yl]-1-ethanone2-chloro-1-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethan-1-one
Database identifiers
- CAS
315710-85-1
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- storage temp.
- 2 · 2-8°C
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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
Suppliers7 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Aladdin Scientific[email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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