AG0032YE

446-17-3 | 2,4,5-Trifluorobenzoic acid

AG0032YE

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CAS Number	446-17-3
Catalog Number	AG0032YE(AGN-PC-0JS9W3)
Chemical Name	2,4,5-Trifluorobenzoic acid
IUPAC Name	2,4,5-trifluorobenzoic acid
InChI	InChI=1S/C7H3F3O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12)
InChI Key	AKAMNXFLKYKFOJ-UHFFFAOYSA-N
MDL Number	MFCD00013306
Molecular Formula	C7H3F3O2
Molecular Weight	176.0927
SMILES	FC1=C(C(=O)O)C=C(C(=C1)F)F
Synonyms	2,4,5-Trifluorobenzoic acid, 446-17-3, 2,4,5-trifluoro-benzoic acid, Benzoic acid, 2,4,5-trifluoro-, MFCD00013306, AKAMNXFLKYKFOJ-UHFFFAOYSA-N, PubChem1346, ACMC-209jyu, AC1LAV84, 2,4,5-Trifluorobenzoicacid, KSC235O3J, SCHEMBL363928, 2,4,5-trifluoro benzoic acid, RARECHEM AL BO 0258, AKAMNXFLKYKFOJ-UHFFFAOYSA-, CTK1D5734, DTXSID20334571, ZINC164626, AC1Q7310, ACT00244, KS-000000FI, ANW-30148, CT-043, SBB063038, 2,4,5-Trifluorobenzoic acid, 99%, AKOS005063814, AB01123, AC-4008, AS-9410, AS01907, CM12880, LS11174, PF10958, RP23757, RTR-017131, TRA0017903, VZ22359, AC-18421, AJ-16244, AK-27025, AN-12417, BC201128, BR-27025, SC-04560, SY009667, AB0008342, DB-025757, TL8003115, TR-017131, AM20040492, FT-0609805, ST24032268, ST50307220, MFCD00013306 (98%), 46T173, M-2696, I01-0164, J-507056, F0001-1214, InChI=1/C7H3F3O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12), p-Propoxybenzoic acid, 4-Propoxybenzoic acid, p-Propyloxybenzoic acid, 4-n-Propoxybenzoic acid, 4-n-Propyloxybenzoic acid, 2,4,6-Trifluorobenzoic acid, Benzoic acid, 4-propoxy-, AKOS BBB/260, ZERENEX ZX008953, 4-PROPYLOXYBENZOIC ACID, C7H3F3O2, RARECHEM AL BO 0832, 4-N-PROPOXYLBENZOIC ACID, TIMTEC-BB SBB006543, CID521170, LABOTEST-BB LT00114428, LABOTEST-BB LT03332263, ACN-032381, OTAVA-BB 7119572505, A7082, T1586, 2,4,5-Trifluorobenzoic acid, 99% - 25G 25g, 28314-80-9,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.009g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.094g/mol
Monoisotopic Mass	176.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number