Cas no 72424-02-3 (Phenol, 3-tridecyl-)
Phenol, 3-tridecyl- structure
Product Name:Phenol, 3-tridecyl-
CAS No:72424-02-3
MF:C19H32O
MW:276.456786155701
CID:573664
PubChem ID:155892
Update Time:2025-04-19
Phenol, 3-tridecyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 3-tridecyl-
- 3-tridecylphenol
- DTXSID50222715
- LMPK15010003
- IFGRPNIAGKTMCH-UHFFFAOYSA-N
- NS00094723
- m-tridecylphenol
- BDBM50259929
- 72424-02-3
- Cardanol C13:0
- CHEMBL448270
- EX-A6677
- CHEBI:186150
- SCHEMBL6557699
- 3-tridecyl phenol
-
- Inchi： 1S/C19H32O/c1-2-3-4-5-6-7-8-9-10-11-12-14-18-15-13-16-19(20)17-18/h13,15-17,20H,2-12,14H2,1H3
- InChI Key： IFGRPNIAGKTMCH-UHFFFAOYSA-N
- SMILES： OC1=CC=CC(=C1)CCCCCCCCCCCCC
Computed Properties
- Exact Mass: 276.24546
- Monoisotopic Mass: 276.245
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 12
- Complexity: 202
- 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: 8.4
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 0.914
- Boiling Point: 392.3°C at 760 mmHg
- Flash Point: 227.2°C
- Refractive Index: 1.498
- PSA: 20.23
Phenol, 3-tridecyl- Related Literature
-
Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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