Cas no 62425-53-0 (Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]-)
![Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/62500/62425-53-0x500.png)
62425-53-0 structure
Product Name:Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]-
CAS No:62425-53-0
MF:C13H10BrClO2
MW:313.574302196503
CID:445239
PubChem ID:9796866
Update Time:2025-04-19
Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 2-[(5-bromo-2-hydroxyphenyl)methyl]-4-chlorophenol
- Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]-
- DTXSID40430882
- 62425-53-0
-
- Inchi： 1S/C13H10BrClO2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2
- InChI Key： PIGVIJUYKAIPIS-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)CC1C=C(C=CC=1O)Cl)O
Computed Properties
- Exact Mass: 311.9553
- Monoisotopic Mass: 311.95527g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 252
- 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: 4.3
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
Phenol, 4-bromo-2-[(5-chloro-2-hydroxyphenyl)methyl]- Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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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
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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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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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