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15823-53-7 | Benzamide, N-butyl-2-ethoxy-
CAS No: 15823-53-7 Catalog No: AG001Q28 MDL No:
Product Description
Catalog Number:
AG001Q28
Chemical Name:
Benzamide, N-butyl-2-ethoxy-
CAS Number:
15823-53-7
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
IUPAC Name:
N-butyl-2-ethoxybenzamide
InChI:
InChI=1S/C13H19NO2/c1-3-5-10-14-13(15)11-8-6-7-9-12(11)16-4-2/h6-9H,3-5,10H2,1-2H3,(H,14,15)
InChI Key:
PSCDMBITSBATQC-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)c1ccccc1OCC
NSC Number:
406388
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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