Cas no 1806429-58-2 (3,5-Dimethyl-4-fluoromandelic acid)
1806429-58-2 structure
Product Name:3,5-Dimethyl-4-fluoromandelic acid
CAS No:1806429-58-2
MF:C10H11FO3
MW:198.190946817398
CID:4939224
Update Time:2023-08-22
3,5-Dimethyl-4-fluoromandelic acid Chemical and Physical Properties
Names and Identifiers
-
- 3,5-Dimethyl-4-fluoromandelic acid
-
- Inchi： 1S/C10H11FO3/c1-5-3-7(9(12)10(13)14)4-6(2)8(5)11/h3-4,9,12H,1-2H3,(H,13,14)
- InChI Key： LORDCQAABUWLTI-UHFFFAOYSA-N
- SMILES： FC1=C(C)C=C(C=C1C)C(C(=O)O)O
Computed Properties
- Exact Mass: 198.06922237 g/mol
- Monoisotopic Mass: 198.06922237 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 207
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 198.19
- XLogP3: 1.7
- Topological Polar Surface Area: 57.5
3,5-Dimethyl-4-fluoromandelic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A015027897-250mg |
3,5-Dimethyl-4-fluoromandelic acid |
1806429-58-2 | 97% | 250mg |
499.20 USD | 2021-06-17 | |
| Alichem | A015027897-500mg |
3,5-Dimethyl-4-fluoromandelic acid |
1806429-58-2 | 97% | 500mg |
815.00 USD | 2021-06-17 | |
| Alichem | A015027897-1g |
3,5-Dimethyl-4-fluoromandelic acid |
1806429-58-2 | 97% | 1g |
1,504.90 USD | 2021-06-17 |
3,5-Dimethyl-4-fluoromandelic acid Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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