CAS
939760-33-5 Purity
96%
939760-33-5 Purity
96%
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[2-Amino-2-(4-trifluoromethyl-phenyl)-ethyl]-carbamic acid tert-butyl ester
CAS
939760-56-2
Catalog Number
ACM939760562
Category
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What is the molecular formula of the compound?
The molecular formula of the compound is C14H19F3N2O2.
What is the IUPAC Name of the compound?
The IUPAC Name is tert-butyl N-[2-amino-2-[4-(trifluoromethyl)phenyl]ethyl]carbamate.
What is the InChIKey for the compound?
The InChIKey is BJJBEYFFWYLMAJ-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CC(C)(C)OC(=O)NCC(C1=CC=C(C=C1)C(F)(F)F)N.
What is the molecular weight of the compound?
The molecular weight is 304.31 g/mol.
How many hydrogen bond donor counts are there in the compound?
There are 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts are there in the compound?
There are 6 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 64.4 Å2.
How many rotatable bond counts are there in the compound?
There are 5 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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