Cas no 41989-08-6 (Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI))
41989-08-6 structure
Product Name:Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI)
CAS No:41989-08-6
MF:C8H18KO4P
MW:248.298184871674
CID:332193
PubChem ID:23677327
Update Time:2025-04-19
Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI)
- potassium octyl hydrogen phosphate
- NS00088535
- EINECS 255-609-6
- 41989-08-6
- Octyl dihydrogen phosphate, potassium salt
- SCHEMBL14976589
- EINECS 257-746-7
- 52215-22-2
- DTXSID80885953
-
- Inchi： 1S/C8H19O4P.K/c1-2-3-4-5-6-7-8-12-13(9,10)11;/h2-8H2,1H3,(H2,9,10,11);/q;+1/p-1
- InChI Key： VMUBRIXOHLRVGV-UHFFFAOYSA-M
- SMILES： [K+].P(=O)(O)([O-])OCCCCCCCC
Computed Properties
- Exact Mass: 248.057977
- Monoisotopic Mass: 248.057977
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 8
- Complexity: 165
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 69.6
Experimental Properties
- Boiling Point: 328.4°Cat760mmHg
- Flash Point: 152.4°C
- PSA: 79.40000
- LogP: 2.89440
Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI) Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
41989-08-6 (Phosphoric acid, monooctyl ester, monopotassiumsalt (9CI)) Related Products
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