Cas no 5468-74-6 (2-[(2-bromophenyl)methyl]-4-methylphenol)
5468-74-6 structure
Product Name:2-[(2-bromophenyl)methyl]-4-methylphenol
CAS No:5468-74-6
MF:C14H13BrO
MW:277.156423330307
CID:942552
PubChem ID:225532
Update Time:2025-04-19
2-[(2-bromophenyl)methyl]-4-methylphenol Chemical and Physical Properties
Names and Identifiers
-
- 2-[(2-bromophenyl)methyl]-4-methylphenol
- 2-(2-Brom-benzyl)-4-methyl-phenol
- 2-(2-bromobenzyl)-4-methylphenol
- 2-(2-bromo-benzyl)-4-methyl-phenol
- AC1L5E3R
- AC1Q26E7
- AG-J-49050
- AR-1C6542
- CTK5A2279
- NSC15070
- DTXSID40280001
- 5468-74-6
- NSC-15070
-
- Inchi: 1S/C14H13BrO/c1-10-6-7-14(16)12(8-10)9-11-4-2-3-5-13(11)15/h2-8,16H,9H2,1H3
- InChI Key: ZNIDNYDBMKCRHD-UHFFFAOYSA-N
- SMILES: BrC1C=CC=CC=1CC1C(=CC=C(C)C=1)O
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: 373.9°C at 760 mmHg
- Flash Point: 179.9°C
- Refractive Index: 1.617
- PSA: 20.23
- LogP: 4.05390
2-[(2-bromophenyl)methyl]-4-methylphenol Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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