Cas no 2412-30-8 (Sulfuric acid,mono(2-methylpropyl) ester)
2412-30-8 structure
Product Name:Sulfuric acid,mono(2-methylpropyl) ester
CAS No:2412-30-8
MF:C4H10O4S
MW:154.184800624847
CID:267103
PubChem ID:202514
Update Time:2025-04-19
Sulfuric acid,mono(2-methylpropyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Sulfuric acid,mono(2-methylpropyl) ester
- 2-methylpropyl hydrogen sulfate
- Isobutyl sulfate
- Isobutyl-hydrogensulfat
- Isobutylschwefelsaeure
- Monoisobutylsulfat
- Schwefelsaeure-monoisobutylester
- sulfuric acid monoisobutyl ester
- SCHEMBL4667979
- SULFURIC ACID, MONOISOBUTYL ESTER
- MKF79E7F56
- NSC-9570
- DTXSID10276810
- JVNPHYVDWYJFES-UHFFFAOYSA-N
- Isobutylsulfat
- Isobutyl hydrogen sulfate
- 2412-30-8
- sulfuric acid monoisobutylester
- (2-Methylpropoxy)sulfonic acid
- NSC9570
- Sulfuric acid, mono(2-methylpropyl) ester
-
- Inchi： 1S/C4H10O4S/c1-4(2)3-8-9(5,6)7/h4H,3H2,1-2H3,(H,5,6,7)
- InChI Key： JVNPHYVDWYJFES-UHFFFAOYSA-N
- SMILES： S(=O)(=O)(O)OCC(C)C
Computed Properties
- Exact Mass: 154.03000
- Monoisotopic Mass: 154.02997997g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 152
- 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: 0.5
- Topological Polar Surface Area: 72?2
Experimental Properties
- PSA: 71.98000
- LogP: 1.54260
Sulfuric acid,mono(2-methylpropyl) ester Related Literature
-
1. A modified ice calorimeter. Heat of reaction between hexene-1 and sulphuric acidK. L. Butcher,G. M. Nickson Trans. Faraday Soc. 1958 54 1195
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