3-(1,3-Benzodioxol-5-yl)-2-methylpropanoic acid | CAS No. 77269-66-0

3-(1,3-Benzodioxol-5-yl)-2-methylpropanoic acid

Basic Information

CAS Number

77269-66-0

Molecular Formula

C11H12O4

Molecular Weight

208.21 g/mol

AD

Basic Physical Properties

Melting Point

77-80℃

Water Solubility

Slightly soluble in water.

CC(CC1=CC2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C11H12O4/c1-7(11(12)13)4-8-2-3-9-10(5-8)15-6-14-9/h2-3,5,7H,4,6H2,1H3,(H,12,13)

InChIKey

DBXAHUCZEXVUKS-UHFFFAOYSA-N

LogP

1.6784999999999999

Topological Polar Surface Area

55.760000000000005 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

241

Synonyms & References

English

  • CDA26966
  • CHEMBL1983369
  • alpha- Methyl-1,3-benzodioxole-5-propanoic Acid
  • 3-(1,3-benzodioxol-5-yl)-2-methylpropanoic acid
  • 2-Methyl-3-[(3,4-methylenedioxy)phenyl]propionic acid
  • alpha- Methyl-1,?3-benzodioxole-?5-?propanoic Acid
  • MLS-0466782.0001
  • 3-(Benzo[d][1,3]dioxol-5-yl)-2-methylpropanoic acid
  • AKOS000314076
  • +/-- Methyl-1,3-benzodioxole-5-propanoic Acid
  • 77269-66-0
  • MFCD06203229
  • 3-(Benzo[d][1,3]dioxol-5-yl)-2-methylpropanoicacid
  • CS-0264408
  • 3-(1,3-Benzodioxol-5-yl)-2-methyl-propanoic acid
  • SCHEMBL3098519
  • 3-(2H-1,3-benzodioxol-5-yl)-2-methylpropanoic acid
  • EN300-92729
  • 3-(1,3-Dioxaindan-5-yl)-2-methylpropanoic acid
  • DTXSID50599090
  • α- Methyl-1,​3-benzodioxole-​5-​propanoic Acid

MDL Number

MFCD06203229

Customs Code

2932999099

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