CAS
93247-78-8 Purity
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93247-78-8 Purity
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Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate
CAS
93250-97-6
Catalog Number
ACM93250976
Category
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What is the molecular formula of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The molecular formula is C17H23NO4.
What is the molecular weight of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The molecular weight is 305.4 g/mol.
What is the IUPAC name of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The IUPAC name is methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate.
What is the InChI of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The InChI is InChI=1S/C17H23NO4/c1-16(2,3)14-18(12-19)17(11-22-14,15(20)21-4)10-13-8-6-5-7-9-13/h5-9,12,14H,10-11H2,1-4H3.
What is the InChIKey of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The InChIKey is ADKXLUKJSWRKDS-UHFFFAOYSA-N.
What is the canonical SMILES of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The canonical SMILES is CC(C)(C)C1N(C(CO1)(CC2=CC=CC=C2)C(=O)OC).
What is the XLogP3-AA of Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate?
The XLogP3-AA is 3.
How many hydrogen bond donor counts does Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate have?
It has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate have?
It has 4 hydrogen bond acceptor counts.
How many rotatable bond counts does Methyl 4-benzyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate have?
It has 5 rotatable bond counts.
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