Cas no 41138-37-8 (Bis(6-hydroxyhexyl) terephthalate)
41138-37-8 structure
Product Name:Bis(6-hydroxyhexyl) terephthalate
CAS No:41138-37-8
MF:C20H30O6
MW:366.448606967926
CID:2634596
PubChem ID:12283180
Update Time:2025-04-21
Bis(6-hydroxyhexyl) terephthalate Chemical and Physical Properties
Names and Identifiers
-
- bis(6-hydroxyhexyl) benzene-1,4-dicarboxylate
- DTXSID00484189
- Bis(6-hydroxyhexyl) terephthalate
- UNII-820Y51088U
- 1,4-Benzenedicarboxylic acid, 1,4-bis(6-hydroxyhexyl) ester
- Q27269285
- 1,4-Benzenedicarboxylic acid, bis(6-hydroxyhexyl) ester
- SCHEMBL8840754
- 41138-37-8
- 1,4-Bis(6-hydroxhexyl) terephthalate
- 820Y51088U
-
- Inchi： 1S/C20H30O6/c21-13-5-1-3-7-15-25-19(23)17-9-11-18(12-10-17)20(24)26-16-8-4-2-6-14-22/h9-12,21-22H,1-8,13-16H2
- InChI Key： ZZMUWHGXJZTWHM-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(=CC=1)C(=O)OCCCCCCO)=O)CCCCCCO
Computed Properties
- Exact Mass: 366.20423867Da
- Monoisotopic Mass: 366.20423867Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 16
- Complexity: 340
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 93.1?2
Bis(6-hydroxyhexyl) terephthalate Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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