6-Methyl-5-phenylmethoxy-1H-indole-3-carbaldehyde - CAS 1071973-86-8
Catalog: |
BB044550 |
Product Name: |
6-Methyl-5-phenylmethoxy-1H-indole-3-carbaldehyde |
CAS: |
1071973-86-8 |
Synonyms: |
5-(Benzyloxy)-6-methyl-1H-indole-3-carbaldehyde; 1H-Indole-3-carboxaldehyde, 6-methyl-5-(phenylmethoxy)- |
IUPAC Name: | 6-methyl-5-phenylmethoxy-1H-indole-3-carbaldehyde |
Description: | 6-Methyl-5-phenylmethoxy-1H-indole-3-carbaldehyde (CAS# 1071973-86-8 ) is a useful research chemical. |
Molecular Weight: | 265.31 |
Molecular Formula: | C17H15NO2 |
Canonical SMILES: | CC1=CC2=C(C=C1OCC3=CC=CC=C3)C(=CN2)C=O |
InChI: | InChI=1S/C17H15NO2/c1-12-7-16-15(14(10-19)9-18-16)8-17(12)20-11-13-5-3-2-4-6-13/h2-10,18H,11H2,1H3 |
InChI Key: | GYCDKDBEGNWKJZ-UHFFFAOYSA-N |
Boiling Point: | 471.1±40.0 °C (Predicted) |
Purity: | 97 % |
Density: | 1.236±0.06 g/cm3 (Predicted) |
Complexity: | 327 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.110278721 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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