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129488-46-6 | 4-tert-Butyl-N-(4-chlorophenyl)benzamide
CAS No: 129488-46-6 Catalog No: AG01FBY6 MDL No:
Product Description
Catalog Number:
AG01FBY6
Chemical Name:
4-tert-Butyl-N-(4-chlorophenyl)benzamide
CAS Number:
129488-46-6
Molecular Formula:
C17H18ClNO
Molecular Weight:
287.7839
IUPAC Name:
4-tert-butyl-N-(4-chlorophenyl)benzamide
InChI:
InChI=1S/C17H18ClNO/c1-17(2,3)13-6-4-12(5-7-13)16(20)19-15-10-8-14(18)9-11-15/h4-11H,1-3H3,(H,19,20)
InChI Key:
ALSXZIRSQXGVLV-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.108g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.787g/mol
Monoisotopic Mass:
287.108g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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