Cas no 61621-82-7 (Benzene, 1,1'-(1,16-hexadecanediyl)bis[3,5-dimethoxy-)
61621-82-7 structure
Product Name:Benzene, 1,1'-(1,16-hexadecanediyl)bis[3,5-dimethoxy-
CAS No:61621-82-7
MF:C32H50O4
MW:498.737010478973
CID:472484
PubChem ID:71394033
Update Time:2025-04-19
Benzene, 1,1'-(1,16-hexadecanediyl)bis[3,5-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1-[16-(3,5-dimethoxyphenyl)hexadecyl]-3,5-dimethoxybenzene
- DTXSID90815766
- 1,1'-(Hexadecane-1,16-diyl)bis(3,5-dimethoxybenzene)
- 61621-82-7
- Benzene, 1,1'-(1,16-hexadecanediyl)bis[3,5-dimethoxy-
-
- Inchi： 1S/C32H50O4/c1-33-29-21-27(22-30(25-29)34-2)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-28-23-31(35-3)26-32(24-28)36-4/h21-26H,5-20H2,1-4H3
- InChI Key： FKVBZHUBSPGQPT-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C=C(C=1)CCCCCCCCCCCCCCCCC1C=C(C=C(C=1)OC)OC)OC
Computed Properties
- Exact Mass: 498.3711
- Monoisotopic Mass: 498.37091007g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 36
- Rotatable Bond Count: 21
- Complexity: 431
- 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: 11.6
- Topological Polar Surface Area: 36.9?2
Experimental Properties
- PSA: 36.92
Benzene, 1,1'-(1,16-hexadecanediyl)bis[3,5-dimethoxy- Related Literature
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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