112822-85-2
2,4,5-TRIFLUORO-3-METHYLBENZOIC ACID
Name
2,4,5-TRIFLUORO-3-METHYLBENZOIC ACID
Formula
C8 H5 F3 O2
MolWeight
190.12
1Identification
【Name】
2,4,5-TRIFLUORO-3-METHYLBENZOIC ACID
【CAS】
【MDL】
MFCD04972492
【English Synonyms】
【Formula】
C8 H5 F3 O2
【MolWeight】
190.12
【Inchi】
InChI=1S/C8H5F3O2/c1-3-6(10)4(8(12)13)2-5(9)7(3)11/h2H,1H3,(H,12,13)
【InChIKey】
InChIKey=CISXRFRLKWCFJS-UHFFFAOYSA-N
【SMILES】
Cc1c(c(cc(c1F)F)C(=O)O)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2,4,5-TRIFLUORO-3-METHYLBENZOIC ACID.cml
Quick Release
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