Products for Research Use Only
RegisterLogin

3-Indoleacrylic acid

CAT: 1410-M35938-01Size: 500 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M35938-01Size:500 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
3-Indoleacrylic acid is a metabolite of tryptophan produced by Peptostreptococcus species. 3-Indoleacrylic acid has a beneficial effect on intestinal epithelial barrier function and mitigates inflammatory responses by immune cells.
CAS Number
1204-06-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
187.19
Molecular Formula
C11H9NO2
Notes
Research use only, not for human use.
Receptor
Endogenous Metabolite

Chemical Information

3-Indoleacrylic acid

(E)-3-(indol-3-yl)acrylic acid is an alpha,beta-unsaturated monocarboxylic acid that is acrylic acid in which one of the hydrogens at position 3 is replaced by an indol-3-yl group. It is a member of indoles and an alpha,beta-unsaturated monocarboxylic acid. It is functionally related to an acrylic acid. It is a conjugate acid of an (E)-3-(indol-3-yl)acrylate(1-).

CAS Number1204-06-4
PubChem CID5375048
IUPAC Name(E)-3-(1H-indol-3-yl)prop-2-enoic acid
Molecular FormulaC11H9NO2
Molecular Weight187.19
XLogP2.2
Topological Polar Surface Area53.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity250
SMILES
C1=CC=C2C(=C1)C(=CN2)/C=C/C(=O)O
InChI
InChI=1S/C11H9NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-7,12H,(H,13,14)/b6-5+
InChIKey
PLVPPLCLBIEYEA-AATRIKPKSA-N
Chemical Structure
2D Structure
2D structure of 3-Indoleacrylic acid
CAS: 1204-06-4
CID: 5375048
Formula: C11H9NO2
MW: 187.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight187.19
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass187.063328530
Monoisotopic Mass187.063328530
Topological Polar Surface Area53.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity250
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
M31343-013-Galloylquinic acid
M31323-013-Epidehydrotumulosic acid
M35899-013-Mercaptopropionic acid
M33583-013-​Oxocholic acid
M33582-013-Methylvaleric Acid
M28858-013-Hydroxyoctanoic Acid
M20869-013-Guanidinopropionic Acid
M20794-013-Hydroxycapric acid
M20515-013-Bromopyruvic acid
M20269-013-Methylbutanoic acid

Alternative Products

CatalogName
I5774703-Indoleacrylic Acid
HY-159959-01Cis-3-Indoleacrylic acid
TMIH-0046-013-Indoleacrylic acid-d4
sc-255675Trans-3-Indoleacrylic acid
I01400-013-Indoleacrylic acid 98%

Popular Products