CAS
92599-77-4 Purity
96%
92599-77-4 Purity
96%
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5-Methoxy-1-[tris(1-methylethyl)silyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxaldehyde
CAS
926004-76-4
Catalog Number
ACM926004764
Category
Other Products
Molecular Formula
C18H28N2O2Si
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Specification
Synonyms
1H-Pyrrolo[2,3-b]pyridine-4-carboxaldehyde, 5-methoxy-1-[tris(1-methylethyl)silyl]-
What is the molecular formula of the compound?
The molecular formula of the compound is C18H28N2O2Si.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 5-methoxy-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C18H28N2O2Si/c1-12(2)23(13(3)4,14(5)6)20-9-8-15-16(11-21)17(22-7)10-19-18(15)20/h8-14H,1-7H3.
What is the InChIKey of the compound?
The InChIKey of the compound is JQXSSFHCFVMTLD-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CC(C)[Si](C(C)C)(C(C)C)N1C=CC2=C(C(=CN=C21)OC)C=O.
What is the computed molecular weight of the compound?
The computed molecular weight of the compound is 332.5 g/mol.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 6 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 44.1 Ų.
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