AG003G75

83012-13-9 | 2,8-BIS(TRIFLUOROMETHYL)-4-CHLOROQUINOLINE

AG003G75

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CAS Number	83012-13-9
Catalog Number	AG003G75(AGN-PC-0KK5YC)
Chemical Name	2,8-BIS(TRIFLUOROMETHYL)-4-CHLOROQUINOLINE
EC Number	280-132-5
IUPAC Name	4-chloro-2,8-bis(trifluoromethyl)quinoline
InChI	InChI=1S/C11H4ClF6N/c12-7-4-8(11(16,17)18)19-9-5(7)2-1-3-6(9)10(13,14)15/h1-4H
InChI Key	ZSQOESPYYNJBCZ-UHFFFAOYSA-N
MDL Number	MFCD00075104
Molecular Formula	C11H4ClF6N
Molecular Weight	299.5996
SMILES	FC(C1=C2N=C(C(F)(F)F)C=C(Cl)C2=CC=C1)(F)F
Synonyms	83012-13-9, 4-Chloro-2,8-bis(trifluoromethyl)quinoline, 2,8-Bis(trifluoromethyl)-4-chloroquinoline, 4-Chloro-2,8-bis-trifluoromethylquinoline, 4-Chloro-2,8-bis-trifluoromethyl-quinoline, AK-29560, Quinoline, 4-chloro-2,8-bis(trifluoromethyl)-, MFCD00075104, EINECS 280-132-5, PubChem5932, ACMC-1BJLJ, AC1MBYG4, 6-Chloro-2,8-bis(trifluoromethyl)quinoline, KSC650E9N, SCHEMBL1258312, CTK5F0296, DTXSID20232129, ZSQOESPYYNJBCZ-UHFFFAOYSA-N, QU023, ACT01938, CS-D0693, ZINC2149531, ZX-AP002849, PC9012, AKOS005259145, AB02852, AC-7386, AN-9071, CC-1405, MCULE-6608130710, PS-7134, RP06812, TRA0030750, VQ10074, KS-00000E25, AJ-33639, BR-29560, CC-08253, CJ-07792, CJ-33071, SC-06895, SY005990, 4-chloro-2,8-di(trifluoromethyl)quinoline, AB0021076, AB1006529, AX8000679, TC-020330, 2,8-bis-(trifluoromethyl)-4-chloroquinoline, FT-0610760, ST24032771, ST50306862, V2252, 4-chloranyl-2,8-bis(trifluoromethyl)quinoline, Quinoline,4-chloro-2,8-bis(trifluoromethyl)-, B-1772, MFCD00075104 (97+%), 4-Chloro-2,8-bis(trifluoromethyl)quinoline, 97%, A840489, C-18721, J-514925, null, C11H4ClF6N, C11-H4-Cl-F6-N, ACN-S002059, 2,8-BIS -4-CHLOROQUINOLINE, ZINC02149531, CID2733247,

Complexity	328
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	298.994g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	299.6g/mol
Monoisotopic Mass	298.994g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number