CAS
914348-91-7 Purity
96%
914348-91-7 Purity
96%
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1H-Indole-1-carboxylicacid,3-formyl-5-methyl-,1,1-dimethylethyl ester
CAS
914348-94-0
Catalog Number
ACM914348940
Category
Other Products
Molecular Formula
C15H17NO3
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What is the molecular formula of the compound with PubChem CID 40428521?
The molecular formula is C15H17NO3.
What is the molecular weight of the compound?
The molecular weight is 259.30 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is tert-butyl 3-formyl-5-methylindole-1-carboxylate.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES is CC1=CC2=C(C=C1)N(C=C2C=O)C(=O)OC(C)(C)C.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.1.
What is the Topological Polar Surface Area of the compound?
The Topological Polar Surface Area is 48.3 Ų.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the InChIKey of the compound?
The InChIKey is FZPLYFQLNOVYNL-UHFFFAOYSA-N.
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