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76204-05-2 | Benzamide, N-(1,1-dimethylethyl)-4-methyl-N-[(4-methylbenzoyl)oxy]-
CAS No: 76204-05-2 Catalog No: AG005EVV MDL No:
Product Description
Catalog Number:
AG005EVV
Chemical Name:
Benzamide, N-(1,1-dimethylethyl)-4-methyl-N-[(4-methylbenzoyl)oxy]-
CAS Number:
76204-05-2
Molecular Formula:
C20H23NO3
Molecular Weight:
325.4015
IUPAC Name:
[tert-butyl-(4-methylbenzoyl)amino] 4-methylbenzoate
InChI:
InChI=1S/C20H23NO3/c1-14-6-10-16(11-7-14)18(22)21(20(3,4)5)24-19(23)17-12-8-15(2)9-13-17/h6-13H,1-5H3
InChI Key:
VJCDSDROFFMVRS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)ON(C(C)(C)C)C(=O)c1ccc(cc1)C
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.408g/mol
Monoisotopic Mass:
325.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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