Molecular Structure:
CAS No.:
126541-81-9
Product Name.:
CCD No.:CCD00738833
Formula:C9 H6 F3 N O4
MolWeight:249.143
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| Product Name： | METHYL 3-NITRO-4-TRIFLUOROMETHYLBENZOATE |
| CAS： | 126541-81-9 |
| English Synonyms： | 3-NITRO-4-(TRIFLUOROMETHYL)BENZOIC ACID METHYL ESTER ; METHYL 3-NITRO-4-TRIFLUOROMETHYLBENZOATE ; METHYL 4-TRIFLUOROMETHYL-3-NITROBENZOATE |
| MDL Number.： | MFCD09264510 |
| H bond acceptor： | 5 |
| H bond donor： | 0 |
| Smile： | COC(=O)c1ccc(c(c1)[N+](=O)[O-])C(F)(F)F |
| InChi： | InChI=1S/C9H6F3NO4/c1-17-8(14)5-2-3-6(9(10,11)12)7(4-5)13(15)16/h2-4H,1H3 |
| InChiKey： | InChIKey=DKARPFALPFVMPB-UHFFFAOYSA-N |
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