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Methyl Ethanesulfonate

CAT: 0572-TRC-M304795-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M304795-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1912-28-3
Synonyms
Methyl Ethylsulfonate; Ethanesulfonic Acid Methyl Ester;
Hazard Statement
Combustible liquid and vapour.
Smiles
COS(CC)(=O)=O
Molecular Formula
C3H8O3S
Molecular Weight
124.16
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Ethanesulfonic acid, methyl ester
CAS Number1912-28-3
PubChem CID15952
IUPAC Namemethyl ethanesulfonate
Molecular FormulaC3H8O3S
Molecular Weight124.16
XLogP0
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity118
SMILES
CCS(=O)(=O)OC
InChI
InChI=1S/C3H8O3S/c1-3-7(4,5)6-2/h3H2,1-2H3
InChIKey
YLJRCXSSKLWCDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethanesulfonic acid, methyl ester
CAS: 1912-28-3
CID: 15952
Formula: C3H8O3S
MW: 124.16
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight124.16
XLogP30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass124.01941529
Monoisotopic Mass124.01941529
Topological Polar Surface Area51.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity118
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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BAA91228Methyl ethanesulfonate
OR1066712-01Sodium 2- ((4-formylphenyl) (methyl) amino) ethanesulfonate
449631-01Ethyl Ethanesulfonate
OR1030231-01Sodium Ethanesulfonate
HY-115389Argimesna (ethanesulfonate)
RG-P181522-01Propyl Ethanesulfonate
OR74932-01Isopropyl ethanesulfonate
AR-N01588-01Nintedanib Ethanesulfonate
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