CAS
914348-95-1 Purity
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914348-95-1 Purity
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1H-Indole-1-carboxylicacid,3-formyl-5-(phenylmethoxy)-,1,1-dimethylethyl ester
CAS
914348-98-4
Catalog Number
ACM914348984
Category
Other Products
Molecular Formula
C21H21NO4
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What is the molecular formula of the compound with the PubChem CID 40428525?
The molecular formula is C21H21NO4.
What are some synonyms for the compound with PubChem CID 40428525?
Some synonyms include 1-Boc-5-Benzyloxy-3-formylindole, tert-Butyl 5-(benzyloxy)-3-formyl-1H-indole-1-carboxylate, and tert-butyl 3-formyl-5-phenylmethoxyindole-1-carboxylate.
What is the molecular weight of the compound?
The molecular weight is 351.4 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is tert-butyl 3-formyl-5-phenylmethoxyindole-1-carboxylate.
What is the InChI of the compound?
The InChI is InChI=1S/C21H21NO4/c1-21(2,3)26-20(24)22-12-16(13-23)18-11-17(9-10-19(18)22)25-14-15-7-5-4-6-8-15/h4-13H,14H2,1-3H3.
What is the InChIKey of the compound?
The InChIKey is YPZYCNKLMGEYBE-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor 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 is 57.5 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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