Methyl 5,6-Dimethoxyindole-2-carboxylate - CAS 28059-24-7
Catalog: |
BB019757 |
Product Name: |
Methyl 5,6-Dimethoxyindole-2-carboxylate |
CAS: |
28059-24-7 |
Synonyms: |
5,6-dimethoxy-1H-indole-2-carboxylic acid methyl ester; methyl 5,6-dimethoxy-1H-indole-2-carboxylate |
IUPAC Name: | methyl 5,6-dimethoxy-1H-indole-2-carboxylate |
Description: | Methyl 5,6-Dimethoxyindole-2-carboxylate (CAS# 28059-24-7) is a useful research chemical. |
Molecular Weight: | 235.24 |
Molecular Formula: | C12H13NO4 |
Canonical SMILES: | COC1=C(C=C2C(=C1)C=C(N2)C(=O)OC)OC |
InChI: | InChI=1S/C12H13NO4/c1-15-10-5-7-4-9(12(14)17-3)13-8(7)6-11(10)16-2/h4-6,13H,1-3H3 |
InChI Key: | SBCKSKZNFJUHAQ-UHFFFAOYSA-N |
Boiling Point: | 390.2 °C at 760 mmHg |
Density: | 1.252 g/cm3 |
MDL: | MFCD07364623 |
LogP: | 1.97170 |
Publication Number | Title | Priority Date |
EP-3148648-B1 | Hair dyeing process using a composition comprising at least one indol(in)e compound and a polycyclic aromatic compound containing at least ten carbon atoms | 20140527 |
US-10292921-B2 | Hair dyeing process using a composition comprising at least one indol(in)e compound and a polycyclic aromatic compound containing at least ten carbon atoms | 20140527 |
US-2018092822-A1 | Hair dyeing process using a composition comprising at least one indol(in)e compound and a polycyclic aromatic compound containing at least ten carbon atoms | 20140527 |
WO-2015181244-A1 | Hair dyeing process using a composition comprising at least one indol(in)e compound and a polycyclic aromatic compound containing at least ten carbon atoms | 20140527 |
EP-2582351-B1 | Hair dyeing process using a composition comprising at least one indole or indoline compound, a metal salt, hydrogen peroxide and a basifying agent | 20100616 |
PMID | Publication Date | Title | Journal |
21577822 | 20090905 | Methyl 5,6-dimeth-oxy-1H-indole-2-carboxyl-ate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 284 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.0844579 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.0844579 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 60.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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