Name: Name:1H-Indole-3-acetic acid, 4-chloro-, methyl ester
Brand: Angene
SKU: AG002EST
Rating: 90 (10 reviews)

1H-Indole-3-acetic acid, 4-chloro-, methyl ester

CAS No.:

19077-78-2

Catalog Number:

AG002EST

Molecular Formula:

C11H10ClNO2

Molecular Weight:

223.6556

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Product Description

Catalog Number:

AG002EST

Chemical Name:

1H-Indole-3-acetic acid, 4-chloro-, methyl ester

CAS Number:

19077-78-2

Molecular Formula:

C11H10ClNO2

Molecular Weight:

223.6556

MDL Number:

MFCD18641977

IUPAC Name:

methyl 2-(4-chloro-1H-indol-3-yl)acetate

InChI:

InChI=1S/C11H10ClNO2/c1-15-10(14)5-7-6-13-9-4-2-3-8(12)11(7)9/h2-4,6,13H,5H2,1H3

InChI Key:

SYPGJEURLIGNPE-UHFFFAOYSA-N

SMILES:

COC(=O)Cc1c[nH]c2c1c(Cl)ccc2

UNII:

J94KP69SZB

Properties

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.656g/mol

Monoisotopic Mass:

223.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
24-Epibrassinolide, a Phytosterol from the Brassinosteroid Family, Protects Dopaminergic Cells against MPP-Induced Oxidative Stress and Apoptosis.	Journal of toxicology 20110101

Properties