Cas no 686780-96-1 (Phenol, 3,5-bis([2,2':6',2''-terpyridin]-4'-yl)-)
686780-96-1 structure
Product Name:Phenol, 3,5-bis([2,2':6',2''-terpyridin]-4'-yl)-
CAS No:686780-96-1
MF:C36H24N6O
MW:556.61536693573
CID:387540
PubChem ID:71367323
Update Time:2025-04-19
Phenol, 3,5-bis([2,2':6',2''-terpyridin]-4'-yl)- Chemical and Physical Properties
Names and Identifiers
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- Phenol, 3,5-bis([2,2':6',2''-terpyridin]-4'-yl)-
- 3,5-bis(2,6-dipyridin-2-ylpyridin-4-yl)phenol
- 686780-96-1
- 3,5-Di([1~2~,2~2~:2~6~,3~2~-terpyridin]-2~4~-yl)phenol
- 3,5-Di([2,2':6',2''-terpyridin]-4'-yl)phenol
- DTXSID50790449
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- Inchi: 1S/C36H24N6O/c43-28-18-24(26-20-33(29-9-1-5-13-37-29)41-34(21-26)30-10-2-6-14-38-30)17-25(19-28)27-22-35(31-11-3-7-15-39-31)42-36(23-27)32-12-4-8-16-40-32/h1-23,43H
- InChI Key: IUDZGONLSGKMJR-UHFFFAOYSA-N
- SMILES: OC1C=C(C=C(C=1)C1C=C(C2C=CC=CN=2)N=C(C2C=CC=CN=2)C=1)C1C=C(C2C=CC=CN=2)N=C(C2C=CC=CN=2)C=1
Computed Properties
- Exact Mass: 556.20115941g/mol
- Monoisotopic Mass: 556.20115941g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 43
- Rotatable Bond Count: 6
- Complexity: 742
- 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: 5.2
- Topological Polar Surface Area: 97.6?2
Phenol, 3,5-bis([2,2':6',2''-terpyridin]-4'-yl)- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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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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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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