Cas no 93878-29-6 (Hexanedioic acid, 3,3-diphenyl-)
93878-29-6 structure
Product Name:Hexanedioic acid, 3,3-diphenyl-
CAS No:93878-29-6
MF:C18H18O4
MW:298.333125591278
CID:752477
PubChem ID:10469968
Update Time:2025-04-19
Hexanedioic acid, 3,3-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- Hexanedioic acid, 3,3-diphenyl-
- 3,3-diphenylhexanedioic acid
- 93878-29-6
- DTXSID90440496
-
- Inchi： 1S/C18H18O4/c19-16(20)11-12-18(13-17(21)22,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10H,11-13H2,(H,19,20)(H,21,22)
- InChI Key： POGCKUWIJXQYHC-UHFFFAOYSA-N
- SMILES： OC(CC(C1C=CC=CC=1)(C1C=CC=CC=1)CCC(=O)O)=O
Computed Properties
- Exact Mass: 298.12050905g/mol
- Monoisotopic Mass: 298.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 7
- Complexity: 361
- 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: 3
- Topological Polar Surface Area: 74.6?2
Hexanedioic acid, 3,3-diphenyl- Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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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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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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