Cas no 58343-20-7 (2-Butanone, 3,3-dimethyl-1,1-diphenyl-)
58343-20-7 structure
Product Name:2-Butanone, 3,3-dimethyl-1,1-diphenyl-
CAS No:58343-20-7
MF:C18H20O
MW:252.350805282593
CID:342422
PubChem ID:5163479
Update Time:2025-04-19
2-Butanone, 3,3-dimethyl-1,1-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butanone, 3,3-dimethyl-1,1-diphenyl-
- 3,3-dimethyl-1,1-diphenylbutan-2-one
- 58343-20-7
- 3,3-dimethyl-1,1-diphenyl-2-butanone
- DTXSID60409055
- SCHEMBL409758
- AKOS011682667
-
- Inchi： 1S/C18H20O/c1-18(2,3)17(19)16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16H,1-3H3
- InChI Key： HSIQEWKXIJALRF-UHFFFAOYSA-N
- SMILES： O=C(C(C1C=CC=CC=1)C1C=CC=CC=1)C(C)(C)C
Computed Properties
- Exact Mass: 252.1515
- Monoisotopic Mass: 252.151415257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 269
- 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: 4.6
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2-Butanone, 3,3-dimethyl-1,1-diphenyl- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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