Cas no 105552-65-6 (Benzene, 2-(difluoromethoxy)-1,3-dimethyl-)
105552-65-6 structure
Product Name:Benzene, 2-(difluoromethoxy)-1,3-dimethyl-
CAS No:105552-65-6
MF:C9H10F2O
MW:172.171909809113
CID:1155343
PubChem ID:20189528
Update Time:2025-04-20
Benzene, 2-(difluoromethoxy)-1,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-(difluoromethoxy)-1,3-dimethyl-
- AKOS016016102
- 105552-65-6
- PNKVCOHWPFOIMT-UHFFFAOYSA-N
- 2-(difluoromethoxy)-1,3-dimethylbenzene
- SCHEMBL9688509
- 2-(Difluoromethoxy)-1,3-dimethyl-benzene
-
- Inchi： 1S/C9H10F2O/c1-6-4-3-5-7(2)8(6)12-9(10)11/h3-5,9H,1-2H3
- InChI Key： PNKVCOHWPFOIMT-UHFFFAOYSA-N
- SMILES： FC(OC1C(C)=CC=CC=1C)F
Computed Properties
- Exact Mass: 172.07
- Monoisotopic Mass: 172.06997126g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 129
- 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
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Benzene, 2-(difluoromethoxy)-1,3-dimethyl- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
105552-65-6 (Benzene, 2-(difluoromethoxy)-1,3-dimethyl-) Related Products
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