Cas no 27971-69-3 (2-chloro-1,3-dimethoxy-5-methylbenzene)
27971-69-3 structure
Product Name:2-chloro-1,3-dimethoxy-5-methylbenzene
CAS No:27971-69-3
MF:C9H11ClO2
MW:186.635442018509
CID:2074577
PubChem ID:13939349
Update Time:2025-04-21
2-chloro-1,3-dimethoxy-5-methylbenzene Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-1,3-dimethoxy-5-methylbenzene
- 4-Chlor-3,5-dimethoxytoluol
- 4-chloro-3,5-dimethoxytoluene
- Di-Me ether-2-Chloro-5-methyl-1,3-benzenediol
- IOXKXMFPMHDABX-UHFFFAOYSA-N
- SCHEMBL10196078
- CHEBI:204458
- 2,6-dimethoxy-4-methyl-chlorobenzene
- 27971-69-3
- DTXSID601285075
- Benzene, 2-chloro-1,3-dimethoxy-5-methyl-
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- Inchi： 1S/C9H11ClO2/c1-6-4-7(11-2)9(10)8(5-6)12-3/h4-5H,1-3H3
- InChI Key： IOXKXMFPMHDABX-UHFFFAOYSA-N
- SMILES： ClC1=C(C=C(C)C=C1OC)OC
Computed Properties
- Exact Mass: 186.0447573g/mol
- Monoisotopic Mass: 186.0447573g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 127
- 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: 2.9
- Topological Polar Surface Area: 18.5?2
2-chloro-1,3-dimethoxy-5-methylbenzene Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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