CAS
904818-18-4 Purity
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904818-18-4 Purity
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[Cyano-(3,4,5-trimethoxy-phenyl)-methyl]-carbamic acid tert-butyl ester
CAS
904818-28-6
Catalog Number
ACM904818286
Category
Other Products
Molecular Weight
322.36
Molecular Formula
C16H22N2O5
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Specification
Synonyms
[CYANO-(3,4,5-TRIMETHOXY-PHENYL)-METHYL]-CARBAMIC ACID TERT-BUTYL ESTER
What is the molecular formula of [Cyano-(3,4,5-trimethoxy-phenyl)-methyl]-carbamic acid tert-butyl ester?
The molecular formula is C16H22N2O5.
What is the molecular weight of the compound?
The molecular weight is 322.36 g/mol.
What are some synonyms for [Cyano-(3,4,5-trimethoxy-phenyl)-methyl]-carbamic acid tert-butyl ester?
Some synonyms include tert-Butyl [cyano(3,4,5-trimethoxyphenyl)methyl]carbamate and tert-Butyl N-[cyano(3,4,5-trimethoxyphenyl)methyl]carbamate.
What is the IUPAC name of the compound?
The IUPAC name is tert-butyl N-[cyano-(3,4,5-trimethoxyphenyl)methyl]carbamate.
What is the InChI key for the compound?
The InChI key is ZKRLJVLPKIWXMY-UHFFFAOYSA-N.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES is CC(C)(C)OC(=O)NC(C#N)C1=CC(=C(C(=C1)OC)OC)OC.
How many hydrogen bond donors are there in the compound?
There is 1 hydrogen bond donor.
How many hydrogen bond acceptors are there in the compound?
There are 6 hydrogen bond acceptors.
What is the topological polar surface area of the compound?
The topological polar surface area is 89.8 Å2.
Is the compound Canonicalized?
Yes, the compound is canonicalized.
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CAS
904818-35-5 Purity
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904818-35-5 Purity
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