Cas no 5442-20-6 (Phenol,2-[(2-bromophenyl)methyl]-6-methyl-)
![Phenol,2-[(2-bromophenyl)methyl]-6-methyl- structure](https://ossimg.kuujia.com/scimg/5500/5442-20-6x500.png)
5442-20-6 structure
Product Name:Phenol,2-[(2-bromophenyl)methyl]-6-methyl-
CAS No:5442-20-6
MF:C14H13BrO
MW:277.156423330307
CID:379874
PubChem ID:223490
Update Time:2025-04-19
Phenol,2-[(2-bromophenyl)methyl]-6-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-[(2-bromophenyl)methyl]-6-methyl-
- 2-[(2-bromophenyl)methyl]-6-methylphenol
- 2-(2-Brom-benzyl)-6-methyl-phenol
- 2-(2-bromobenzyl)-6-methylphenol
- 2-(2-bromo-benzyl)-6-methyl-phenol
- AC1L5CLL
- AC1Q26EA
- AR-1C6544
- CTK5A0935
- NSC11171
- DTXSID30279060
- NSC-11171
- 5442-20-6
-
- Inchi： 1S/C14H13BrO/c1-10-5-4-7-12(14(10)16)9-11-6-2-3-8-13(11)15/h2-8,16H,9H2,1H3
- InChI Key： YAAGYCLIOGWWBT-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1CC1C=CC=C(C)C=1O
Computed Properties
- Exact Mass: 276.01499
- Monoisotopic Mass: 276.015
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 219
- 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: 4.5
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 1.387
- Boiling Point: 369.5°C at 760 mmHg
- Flash Point: 177.2°C
- Refractive Index: 1.617
- PSA: 20.23
- LogP: 4.05390
Phenol,2-[(2-bromophenyl)methyl]-6-methyl- Related Literature
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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
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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