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940488-53-9 | 4-{3-[(Butylamino)carbonyl]anilino}-4-oxobutanoic acid
CAS No: 940488-53-9 Catalog No: AG01FOC3 MDL No:
Product Description
Catalog Number:
AG01FOC3
Chemical Name:
4-{3-[(Butylamino)carbonyl]anilino}-4-oxobutanoic acid
CAS Number:
940488-53-9
IUPAC Name:
4-[3-(butylcarbamoyl)anilino]-4-oxobutanoic acid
InChI:
InChI=1S/C15H20N2O4/c1-2-3-9-16-15(21)11-5-4-6-12(10-11)17-13(18)7-8-14(19)20/h4-6,10H,2-3,7-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)
InChI Key:
NDAUAORPKBCQEL-UHFFFAOYSA-N
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
292.335g/mol
Monoisotopic Mass:
292.142g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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