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101927-50-8 | Benzamide, 4-(1,1-dimethylethyl)-N-propyl-
CAS No: 101927-50-8 Catalog No: AG0005ZA MDL No:
Product Description
Catalog Number:
AG0005ZA
Chemical Name:
Benzamide, 4-(1,1-dimethylethyl)-N-propyl-
CAS Number:
101927-50-8
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
IUPAC Name:
4-tert-butyl-N-propylbenzamide
InChI:
InChI=1S/C14H21NO/c1-5-10-15-13(16)11-6-8-12(9-7-11)14(2,3)4/h6-9H,5,10H2,1-4H3,(H,15,16)
InChI Key:
FAZVSECXIMKWCT-UHFFFAOYSA-N
SMILES:
CCCNC(=O)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.328g/mol
Monoisotopic Mass:
219.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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