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940212-18-0 | 4-{4-[(3-Methylbutanoyl)amino]anilino}-4-oxobutanoic acid
CAS No: 940212-18-0 Catalog No: AG01FOCA MDL No:
Product Description
Catalog Number:
AG01FOCA
Chemical Name:
4-{4-[(3-Methylbutanoyl)amino]anilino}-4-oxobutanoic acid
CAS Number:
940212-18-0
IUPAC Name:
4-[4-(3-methylbutanoylamino)anilino]-4-oxobutanoic acid
InChI:
InChI=1S/C15H20N2O4/c1-10(2)9-14(19)17-12-5-3-11(4-6-12)16-13(18)7-8-15(20)21/h3-6,10H,7-9H2,1-2H3,(H,16,18)(H,17,19)(H,20,21)
InChI Key:
OTDGIEYLEGUITK-UHFFFAOYSA-N
Properties
Complexity:
374
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:
7
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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