Cas no 401-30-9 (2-(4-fluorobenzyl)phenol)
2-(4-fluorobenzyl)phenol structure
Product Name:2-(4-fluorobenzyl)phenol
CAS No:401-30-9
MF:C13H11FO
MW:202.224247217178
CID:2626628
PubChem ID:258431
Update Time:2025-04-21
2-(4-fluorobenzyl)phenol Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-fluorobenzyl)phenol
- 2-(4-fluorobenzyl)-malonic acid dimethyl ester; 2-(4-fluorobenzyl)phenol; 2-(4-Fluor-benzyl)-phenol; ACMC-1CPD2; 2-Hydroxy-1-(4-fluor-benzyl)-benzol; SureCN5888360; 4-fluorophenylmethylphenol; Dimethyl 2-(4-fluorobenzyl)malonate; ZINC00165473; methyl 3-(4-fluorophenyl)-2-methoxycarbonylpropionate; 2-(4-fluorobenzyl)malonic acid dimethyl ester; 2-(4-fluorobenzyl) phenol; CTK3J6147; AC1MD0D1; 2-(4-fluoro-benzyl)-phenol; Dimethyl (4-Fluoro
- DTXSID20960551
- SCHEMBL2577181
- NCIOpen2_005168
- 2-[(4-fluorophenyl)methyl]phenol
- 401-30-9
- NSC-87336
- NSC87336
- XMPYZRODFDIJPK-UHFFFAOYSA-N
-
- Inchi： 1S/C13H11FO/c14-12-7-5-10(6-8-12)9-11-3-1-2-4-13(11)15/h1-8,15H,9H2
- InChI Key： XMPYZRODFDIJPK-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)CC1C=CC=CC=1O
Computed Properties
- Exact Mass: 202.07943
- Monoisotopic Mass: 202.079393
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 187
- 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: 3.7
- Topological Polar Surface Area: 20.2
Experimental Properties
- Density: 1.179
- Boiling Point: 314°C at 760 mmHg
- Flash Point: 180.8°C
- Refractive Index: 1.584
- PSA: 20.23
- LogP: 3.12210
2-(4-fluorobenzyl)phenol Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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