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Acetylsulfuric acid

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Name

Acetylsulfuric acid

EINECS N/A
CAS No. 2308-54-5 Density 1.677 g/cm3
PSA 89.05000 LogP 0.43310
Solubility N/A Melting Point N/A
Formula C2H4O5S Boiling Point N/A
Molecular Weight 140.117 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 2308-54-5 (Sulfuric  acid,  anhydride  with  acetic  acid) Hazard Symbols N/A
Synonyms

Aceticacid, anhydride with H2SO4 (6CI,7CI);Acetic acid, monoanhydride with sulfuricacid (8CI,9CI);Sulfuric acid, monoanhydride with acetic acid (8CI);Acetosulfuric acid;Acetyl sulfate;Acetyl sulfonic acid;

Article Data 23

Acetylsulfuric acid Specification

The Acetylsulfuric acid, with the CAS registry number 2308-54-5, is also known as Sulfuric acid, monoanhydride with acetic acid. This chemical's molecular formula is C2H4O5S and molecular weight is 140.12. What's more, its systematic name is Acetyl hydrogen sulfate.

Physical properties of Acetylsulfuric acid are: (1)ACD/LogP: -0.835; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.34; (4)ACD/LogD (pH 7.4): -4.34; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 89.05 Å2; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 23.509 cm3; (15)Molar Volume: 83.57 cm3; (16)Polarizability: 9.319×10-24cm3; (17)Surface Tension: 64.0 dyne/cm; (18)Density: 1.677 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OS(=O)(=O)O)C
(2)Std. InChI: InChI=1S/C2H4O5S/c1-2(3)7-8(4,5)6/h1H3,(H,4,5,6)
(3)Std. InChIKey: HZWXJJCSDBQVLF-UHFFFAOYSA-N

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