CAS 128781-07-7 | 1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy- | CAS Number 128781-07-7

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Carboxes > 128781-07-7

128781-07-7 | 1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-

CAS No: 128781-07-7 Catalog No: AG000YDN MDL No:MFCD02664478

Product Description

Catalog Number:

AG000YDN

Chemical Name:

1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-

CAS Number:

128781-07-7

Molecular Formula:

C12H13NO5

Molecular Weight:

251.2353

MDL Number:

MFCD02664478

IUPAC Name:

5,6,7-trimethoxy-1H-indole-2-carboxylic acid

InChI:

InChI=1S/C12H13NO5/c1-16-8-5-6-4-7(12(14)15)13-9(6)11(18-3)10(8)17-2/h4-5,13H,1-3H3,(H,14,15)

InChI Key:

JZMUJQGIASARGH-UHFFFAOYSA-N

SMILES:

COc1cc2cc([nH]c2c(c1OC)OC)C(=O)O

Properties

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

251.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.238g/mol

Monoisotopic Mass:

251.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Synthesis and biological evaluation of a novel pentagastrin-toxin conjugate designed for a targeted prodrug mono-therapy of cancer.	International journal of molecular sciences 20080501
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501