Cas no 178363-68-3 (Cyclohexanone, 4-(3,4-dimethoxyphenyl)-)
178363-68-3 structure
Product Name:Cyclohexanone, 4-(3,4-dimethoxyphenyl)-
CAS No:178363-68-3
MF:C14H18O3
MW:234.290924549103
CID:1366877
PubChem ID:68680918
Update Time:2025-04-20
Cyclohexanone, 4-(3,4-dimethoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 4-(3,4-dimethoxyphenyl)-
- 4-(3,4-dimethoxy-phenyl)-cyclohexanone
- DB-331594
- 178363-68-3
- AKOS019067994
- SCHEMBL3536936
-
- Inchi： 1S/C14H18O3/c1-16-13-8-5-11(9-14(13)17-2)10-3-6-12(15)7-4-10/h5,8-10H,3-4,6-7H2,1-2H3
- InChI Key： ZFNPIMGGFINZOM-UHFFFAOYSA-N
- SMILES： O=C1CCC(C2C=CC(=C(C=2)OC)OC)CC1
Computed Properties
- Exact Mass: 234.12564
- Monoisotopic Mass: 234.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 254
- 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: 1.7
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Cyclohexanone, 4-(3,4-dimethoxyphenyl)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
178363-68-3 (Cyclohexanone, 4-(3,4-dimethoxyphenyl)-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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