3,5-Dimethylbenzoic-d9 Acid
CAS: 1335014-65-7
Ref. TR-D471422
| 25mg | 219.00 € | ||
| 100mg | 635.00 € | ||
| 250mg | 1,233.00 € |
Estimated delivery in United States, on Tuesday 21 May 2024
Product Information
Name:
3,5-Dimethylbenzoic-d9 Acid
Synonyms:
- 3,5-Dimethyl-benzoic-d9 Acid
- Mesitylenic-d9 Acid
- NSC 37562-d9
CAS:
Description:
Applications 3,5-Dimethylbenzoic-d9 Acid is labelled 3,5-Dimethylbenzoic Acid which is a a reagent used to synthesize 5-Benzoyl-m-xylene (B209800). It can also be used to prepare quinoline inhibitors of Dengue viral NS2B-NS3 protease.
References Tachibana, Y., et al.: J. Org. Chem., 71, 5093 (2006); Deng, J., et al.: J. Med. Chem., 55, 6278 (2012)
Brand:
TRC
Long term storage:
Notes:
Chemical properties
Molecular weight:
159.23
Formula:
C9HD9O2
Color/Form:
Neat
InChI:
InChI=1S/C31H50O8/c1-16-19-10-13-30(6)26(29(19,5)12-11-21(16)33)22(34)14-20-25(23(39-17(2)32)15-31(20,30)7)18(27(36)37)8-9-24(35)28(3,4)38/h16,19-24,26,33-35,38H,8-15H2,1-7H3,(H,36,37)/b25-18-/t16-,19-,20-,21+,22+,23-,24?,26-,29-,30-,31-/m0/s1
InChI key:
InChIKey=PGLFLDPZTHZNCH-DMZSZUJBSA-N
SMILES:
CC(=O)O[C@H]1C[C@@]2(C)[C@@H](C[C@@H](O)[C@H]3[C@@]4(C)CC[C@@H](O)[C@@H](C)[C@@H]4CC[C@@]32C)/C1=C(\CCC(O)C(C)(C)O)C(=O)O
MDL:
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EINECS:
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HS code:
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