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Basic information
- CAS
1164457-90-2- Standard SMILES
O=C(O)/C=C/c1cn(-c2ncc(C(F)(F)F)cc2Cl)c2ccccc12- InChIKey
CBPTZQXBTXUKSD-AATRIKPKSA-N- Molecular formula
- C17H10ClF3N2O2
- Average molar mass
- 366.726 g/mol
- Monoisotopic mass
- 366.0382899
Names & identifiers
- Preferred name
- (2E)-3-{1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-indol-3-yl}prop-2-enoic acid
- IUPAC
- (2E)-3-{1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-indol-3-yl}prop-2-enoic acid
- English name
- 3-(1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl)acrylic acid
- Molecular formula
- C17H10ClF3N2O2
- Molecular weight
- 366.72
Names & synonyms
BUTTPARK 153\33-53RARECHEM AL BK 11121-[3-CHLORO-5-(TRIFLUOROMETHYL)PYRID-2-YL]-1H-INDOL-3-YL ACRYLIC ACID1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-indol-3-ylacrylicacid97%3-(1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl)acrylic acid(E)-3-(1-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-1H-indol-3-yl)acrylic acid2-Propenoic acid, 3-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl]-, (2E)-
Database identifiers
- CAS
1164457-90-2- PubChem CID
- 1474089
- DTXSID
DTXSID40363045- ChEMBL
CHEMBL1431337
Properties
Physicochemical properties
- Melting point
- 250 · 250-253°C
- Boiling point
- 428.7 · 428.7±45.0 °C(Predicted)
- Density
- 1.44 · 1.44±0.1 g/cm3(Predicted)
- pka
- 4.32 · 4.32±0.10(Predicted)
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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