1-ISOPROPYL-2-(TRIFLUOROMETHYL)-1H-BENZIMIDAZOLE-5-CARBOXYLIC ACID

CAS No.
306935-42-2
CCD No.
CCD00228762
Formula
C12 H11 F3 N2 O2
MolWeight
272.225

Basic Information

Product Name: 1-ISOPROPYL-2-(TRIFLUOROMETHYL)-1H-BENZIMIDAZOLE-5-CARBOXYLIC ACID
CAS: 306935-42-2
English Synonyms: 1-ISOPROPYL-2-(TRIFLUOROMETHYL)-1,3-BENZODIAZOLE-5-CARBOXYLIC ACID ; 1-(METHYLETHYL)-2-(TRIFLUOROMETHYL)BENZIMIDAZOLE-5-CARBOXYLIC ACID ; 1-(PROPAN-2-YL)-2-(TRIFLUOROMETHYL)-1H-1,3-BENZODIAZOLE-5-CARBOXYLIC ACID ; BUTTPARK 36\04-49 ; 1-ISO-PROPYL-2-(TRIFLUOROMETHYL)BENZIMIDAZOLE-5-CARBOXYLIC ACID ; 1-ISOPROPYL-2-(TRIFLUOROMETHYL)-1H-BENZIMIDAZOLE-5-CARBOXYLIC ACID
MDL Number.: MFCD01570675
H bond acceptor: 4
H bond donor: 1
Smile: CC(C)n1c2ccc(cc2nc1C(F)(F)F)C(=O)O
InChi: InChI=1S/C12H11F3N2O2/c1-6(2)17-9-4-3-7(10(18)19)5-8(9)16-11(17)12(13,14)15/h3-6H,1-2H3,(H,18,19)
InChiKey: InChIKey=AHTNGRMQJZPRNL-UHFFFAOYSA-N

Property

Boiling Point: MP: 174-178 DEG C
Comments: ORIGINAL SKU: CDS015356-100MG
OTHER NOTES: PLEASE NOTE THAT SIGMA-ALDRICH DOES NOT COLLECT ANALYTICAL DATA FOR ALDRICHCPR PRODUCTS AND THAT ALL SALES ARE FINAL.ALL ALDRICHCPR PRODUCTS, AND OTHER BUILDING BLOCKS OR SCREENING COMPOUNDS THAT ARE PART OF THIS COLLECTION, ARE ALSO AVAILABLE AS CUSTOM PACKAGED LIBRARIES-FOR MORE DETAILS ABOUT THIS SERVICE OR FOR FURTHER INFORMATION ON THIS PRODUCT, PLEASE CONTACT US AT ALDRICHCPR AT SIAL.COM

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H301
Precautionary statements: P301 + P310
hazard symbol: Xn
Risk Code: R:22
WGK Germany: 3