Cas no 36440-24-1 (1,3,8-Naphthalenetricarboxylic acid, 1,3,8-trimethyl ester)
36440-24-1 structure
Product Name:1,3,8-Naphthalenetricarboxylic acid, 1,3,8-trimethyl ester
CAS No:36440-24-1
MF:C16H14O6
MW:302.278765201569
CID:921356
Update Time:2023-11-19
1,3,8-Naphthalenetricarboxylic acid, 1,3,8-trimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1,3,8-tricarbomethoxynaphthalene
- Trimethyl 1,3,8-naphthalenetricarboxylate
- CID 101078904
- 1,3,8-Naphthalenetricarboxylic acid, 1,3,8-trimethyl ester
-
- Inchi： 1S/C16H14O6/c1-20-14(17)10-7-9-5-4-6-11(15(18)21-2)13(9)12(8-10)16(19)22-3/h4-8H,1-3H3
- InChI Key： UMSCFCBKDHGOIE-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=C(C(=O)OC)C=C2C=CC=C(C(=O)OC)C2=1)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 6
- Complexity: 446
- Topological Polar Surface Area: 78.9
Experimental Properties
- Density: 1.274±0.06 g/cm3(Predicted)
- Boiling Point: 438.3±25.0 °C(Predicted)
1,3,8-Naphthalenetricarboxylic acid, 1,3,8-trimethyl ester Related Literature
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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