4,7-Dimethoxy-1H-indole-3-carbaldehyde - CAS 170489-17-5
Catalog: |
BB046741 |
Product Name: |
4,7-Dimethoxy-1H-indole-3-carbaldehyde |
CAS: |
170489-17-5 |
Synonyms: |
4,7-dimethoxyindole-3-carboxaldehyde; 4,7-dimethoxy-3-formylindole; 1H-Indole-3-carboxaldehyde, 4,7-dimethoxy- |
IUPAC Name: | 4,7-dimethoxy-1H-indole-3-carbaldehyde |
Description: | 4,7-Dimethoxy-1H-indole-3-carbaldehyde (CAS# 170489-17-5 ) is a useful research chemical. |
Molecular Weight: | 205.21 |
Molecular Formula: | C11H11NO3 |
Canonical SMILES: | COC1=C2C(=CNC2=C(C=C1)OC)C=O |
InChI: | InChI=1S/C11H11NO3/c1-14-8-3-4-9(15-2)11-10(8)7(6-13)5-12-11/h3-6,12H,1-2H3 |
InChI Key: | UOJNCDLJUQYIBQ-UHFFFAOYSA-N |
Boiling Point: | 417.6±40.0 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.3±0.1 g/cm3 |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.07389321 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 51.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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