Cas no 26762-90-3 (Phenol, octyl-,1-(dihydrogen phosphate))
26762-90-3 structure
Product Name:Phenol, octyl-,1-(dihydrogen phosphate)
CAS No:26762-90-3
MF:C14H23O4P
MW:286.303785562515
CID:261976
PubChem ID:117864
Update Time:2025-04-19
Phenol, octyl-,1-(dihydrogen phosphate) Chemical and Physical Properties
Names and Identifiers
-
- Phenol, octyl-,1-(dihydrogen phosphate)
- 4-octylphenyl dihydrogen phosphate
- Octylphenyl dihydrogen phosphate
- Phenol, octyl-, dihydrogen phosphate
- Phosphoric acid, mono(octylphenyl) ester
- (4-octylphenyl) dihydrogen phosphate
- SCHEMBL1100960
- 26762-90-3
- 34332-94-0
- NS00028192
- p-OctylphenylPhosphate
- DTXSID1067251
- EINECS 247-985-5
- Phenol, octyl-, 1-(dihydrogen phosphate)
-
- Inchi： 1S/C14H23O4P/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)18-19(15,16)17/h9-12H,2-8H2,1H3,(H2,15,16,17)
- InChI Key： LCQIKBDZONOEOA-UHFFFAOYSA-N
- SMILES： P(=O)(O)(O)OC1C=CC(=CC=1)CCCCCCCC
Computed Properties
- Exact Mass: 286.13349
- Monoisotopic Mass: 286.133
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 9
- Complexity: 269
- 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: 66.8?2
Experimental Properties
- Density: 1.154
- Boiling Point: 432.4°Cat760mmHg
- Flash Point: 215.3°C
- Refractive Index: 1.521
- PSA: 66.76
Phenol, octyl-,1-(dihydrogen phosphate) Related Literature
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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