3-(Methylsulfonyl)acrylic Acid - CAS 63068-43-9
Catalog: |
BB031978 |
Product Name: |
3-(Methylsulfonyl)acrylic Acid |
CAS: |
63068-43-9 |
Synonyms: |
3-methylsulfonyl-2-propenoic acid; 3-methylsulfonylprop-2-enoic acid |
IUPAC Name: | (E)-3-methylsulfonylprop-2-enoic acid |
Description: | 3-(Methylsulfonyl)acrylic Acid (CAS# 63068-43-9) is a useful research chemical. |
Molecular Weight: | 150.15 |
Molecular Formula: | C4H6O4S |
Canonical SMILES: | CS(=O)(=O)C=CC(=O)O |
InChI: | InChI=1S/C4H6O4S/c1-9(7,8)3-2-4(5)6/h2-3H,1H3,(H,5,6) |
InChI Key: | KUKIFRWOPQFZKI-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
KR-20090112980-A | Method for preparing methyl isozemblon and intermediates therefor | 20080425 |
KR-101176892-B1 | Method for preparing methylzelamblon and intermediate for same | 20080205 |
KR-20090085808-A | Method for preparing methylzelamblon and intermediate for same | 20080205 |
JP-2007320932-A | Process for producing β-naphthols | 20060603 |
JP-2007320933-A | 1-naphthol production method | 20060603 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 149.99867984 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.99867984 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 79.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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