Cas no 89035-09-6 (Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate)
89035-09-6 structure
Product Name:Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate
CAS No:89035-09-6
MF:C31H32O6
MW:500.582189559937
CID:581924
PubChem ID:71321642
Update Time:2025-04-19
Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate Chemical and Physical Properties
Names and Identifiers
-
- benzoic acid,4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,6-dimethylphenol
- 89035-09-6
- Benzoic acid--4,4'-methylenebis(2,6-dimethylphenol) (2/1)
- DTXSID00751429
- Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate
-
- Inchi： 1S/C17H20O2.2C7H6O2/c1-10-5-14(6-11(2)16(10)18)9-15-7-12(3)17(19)13(4)8-15;2*8-7(9)6-4-2-1-3-5-6/h5-8,18-19H,9H2,1-4H3;2*1-5H,(H,8,9)
- InChI Key： XERZDEIHXRMJDZ-UHFFFAOYSA-N
- SMILES： OC1C(C)=CC(=CC=1C)CC1C=C(C)C(=C(C)C=1)O.OC(C1C=CC=CC=1)=O.OC(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 500.21988874g/mol
- Monoisotopic Mass: 500.21988874g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 37
- Rotatable Bond Count: 4
- Complexity: 343
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 115?2
Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
89035-09-6 (Phenol, 4,4'-methylenebis[2,6-dimethyl-, dibenzoate) Related Products
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