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925176-33-6 | 4-[3-(Isobutyrylamino)anilino]-4-oxobutanoic acid
CAS No: 925176-33-6 Catalog No: AG01FOBU MDL No:
Product Description
Catalog Number:
AG01FOBU
Chemical Name:
4-[3-(Isobutyrylamino)anilino]-4-oxobutanoic acid
CAS Number:
925176-33-6
IUPAC Name:
4-[3-(2-methylpropanoylamino)anilino]-4-oxobutanoic acid
InChI:
InChI=1S/C14H18N2O4/c1-9(2)14(20)16-11-5-3-4-10(8-11)15-12(17)6-7-13(18)19/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)(H,16,20)(H,18,19)
InChI Key:
DHRKXHIGLCVDGD-UHFFFAOYSA-N
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
278.308g/mol
Monoisotopic Mass:
278.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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