Cas no 84593-27-1 (Phosphoric acid, 2-methylpropyl ester)
84593-27-1 structure
Product Name:Phosphoric acid, 2-methylpropyl ester
CAS No:84593-27-1
MF:C4H11O4P
MW:154.101502656937
CID:729845
PubChem ID:75574
Update Time:2025-04-19
Phosphoric acid, 2-methylpropyl ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric acid, 2-methylpropyl ester
- 2-methylpropyl phosphate
- Phosphoric acid, mono(2-methylpropyl) ester
- PHOSPHORIC ACID,2-METHYLPROPYL ESTER
- MFCD32222305
- DTXSID80862961
- 84593-27-1
- NS00046743
- 2-methylpropyl dihydrogen phosphate
- SCHEMBL759100
- SY299098
- Isobutyl dihydrogen phosphate
- EINECS 283-250-5
- isobutyl alcohol phosphate
- 2466-73-1
- EINECS 219-576-1
-
- Inchi： 1S/C4H11O4P/c1-4(2)3-8-9(5,6)7/h4H,3H2,1-2H3,(H2,5,6,7)
- InChI Key： SVBLDLLXNRGMBG-UHFFFAOYSA-N
- SMILES： P(=O)(O)(O)OCC(C)C
Computed Properties
- Exact Mass: 154.039
- Monoisotopic Mass: 154.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 116
- 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
- Topological Polar Surface Area: 66.8A^2
- XLogP3: -0.2
Experimental Properties
- Density: 1.279
- Boiling Point: 263.3°Cat760mmHg
- Flash Point: 113°C
- Refractive Index: 1.447
- PSA: 82.23000
- LogP: 1.62810
Phosphoric acid, 2-methylpropyl ester Related Literature
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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