CAS
916516-89-7 Purity
96%
916516-89-7 Purity
96%
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3-(1-Cyano-1-methylethyl)-1H-indole-1,5-dicarboxylic acid 1-(1,1-dimethylethyl)5-methyl ester
CAS
916522-63-9
Catalog Number
ACM916522639
Category
Other Products
Molecular Formula
C19H22N2O4
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Specification
Synonyms
1H-Indole-1,5-dicarboxylic acid, 3-(1-cyano-1-methylethyl)-, 1-(1,1-dimethylethyl) 5-methyl ester
What is the molecular formula of the compound with PubChem CID 68469561?
The molecular formula is C19H22N2O4.
What is the molecular weight of the compound?
The molecular weight is 342.4 g/mol.
What are some synonyms for the compound?
Some synonyms include 916522-63-9, 1H-Indole-1,5-dicarboxylic acid, 3-(1-cyano-1-methylethyl)-, 1-(1,1-dimethylethyl) 5-methyl ester, and more.
What is the IUPAC name of the compound?
The IUPAC name is 1-O-tert-butyl 5-O-methyl 3-(2-cyanopropan-2-yl)indole-1,5-dicarboxylate.
What is the InChIKey of the compound?
The InChIKey is QDXNSJQXDJKHKO-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 81.3 Ų.
How many rotatable bond counts does the compound have?
The compound has 5 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.7.
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CAS
916574-87-3 Purity
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916574-87-3 Purity
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