Cas no 58042-00-5 (Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]-)
![Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]- structure](https://ossimg.kuujia.com/scimg/58500/58042-00-5x500.png)
58042-00-5 structure
Product Name:Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]-
CAS No:58042-00-5
MF:C14H12Cl2O2
MW:283.149882316589
CID:343284
PubChem ID:964380
Update Time:2025-04-19
Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]-
- [3-[(2,4-dichlorophenyl)methoxy]phenyl]methanol
- AKOS000247776
- 58042-00-5
- DTXSID50359454
- STK513760
- SCHEMBL11704301
-
- Inchi： 1S/C14H12Cl2O2/c15-12-5-4-11(14(16)7-12)9-18-13-3-1-2-10(6-13)8-17/h1-7,17H,8-9H2
- InChI Key： GTRFQSISKVIODB-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=CC=1COC1=CC=CC(CO)=C1)Cl
Computed Properties
- Exact Mass: 282.02156
- Monoisotopic Mass: 282.0214350g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 250
- 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: 3.8
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.46
Benzenemethanol, 3-[(2,4-dichlorophenyl)methoxy]- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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