CAS
939760-28-8 Purity
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939760-28-8 Purity
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[2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride
CAS
939760-53-9
Catalog Number
ACM939760539
Category
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What is the molecular formula of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The molecular formula is C14H20ClN3O2.
What is the molecular weight of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The molecular weight is 297.78 g/mol.
What is the IUPAC name of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The IUPAC name is tert-butyl N-[2-amino-2-(4-cyanophenyl)ethyl]carbamate;hydrochloride.
What is the InChIKey of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The InChIKey is QNOKDFGERXNFIH-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
There are 3 hydrogen bond donor counts.
What is the topological polar surface area of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The topological polar surface area is 88.1Ų.
Is the compound is canonicalized?
Yes, the compound is canonicalized.
How many rotatable bond counts are there in [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
There are 5 rotatable bond counts.
What is the complexity value of [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
The complexity value is 345.
How many covalently-bonded units are there in [2-Amino-2-(4-cyano-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride?
There are 2 covalently-bonded units.
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939760-51-7 Purity
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939760-51-7 Purity
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939760-56-2 Purity
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939760-56-2 Purity
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