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127222-69-9 | Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, hydrazide
CAS No: 127222-69-9 Catalog No: AG000WR9 MDL No:MFCD00711879
Product Description
Catalog Number:
AG000WR9
Chemical Name:
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, hydrazide
CAS Number:
127222-69-9
Molecular Formula:
C13H20N2O
Molecular Weight:
220.3107
MDL Number:
MFCD00711879
IUPAC Name:
2-[4-(2-methylpropyl)phenyl]propanehydrazide
InChI:
InChI=1S/C13H20N2O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(16)15-14/h4-7,9-10H,8,14H2,1-3H3,(H,15,16)
InChI Key:
JVDPFQDYGHWBBX-UHFFFAOYSA-N
SMILES:
NNC(=O)C(c1ccc(cc1)CC(C)C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.158g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.316g/mol
Monoisotopic Mass:
220.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Novel NSAID 1-acyl-4-cycloalkyl/arylsemicarbazides and 1-acyl-5-benzyloxy/hydroxy carbamoylcarbazides as potential anticancer agents and antioxidants. | European journal of medicinal chemistry 20120501 |
| 2-(4-Isobutyl-phen-yl)-N'-[(3Z)-2-oxoindolin-3-yl-idene]propano-hydrazide. | Acta crystallographica. Section E, Structure reports online 20120401 |
| (E)-N'-(2-Hydroxy-benzyl-idene)-2-(4-isobutyl-phen-yl)propanohydrazide. | Acta crystallographica. Section E, Structure reports online 20100101 |
| N'-[(E)-4-Bromo-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide. | Acta crystallographica. Section E, Structure reports online 20090601 |
| N'-[(E)-4-Chloro-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide. | Acta crystallographica. Section E, Structure reports online 20090601 |
| 2-(4-Isobutyl-phen-yl)-N'-[1-(4-nitro-phen-yl)ethyl-idene]propanohydrazide. | Acta crystallographica. Section E, Structure reports online 20090301 |
| 1-[2-(4-Isobutyl-phen-yl)propano-yl]thiosemicarbazide. | Acta crystallographica. Section E, Structure reports online 20090301 |
| N'-[(E)-1-(4-Chloro-phen-yl)ethyl-idene]-2-[4-(2-methyl-prop-yl)phen-yl]propano-hydrazide. | Acta crystallographica. Section E, Structure reports online 20090101 |
| 2-[4-(2-Methyl-prop-yl)phen-yl]-N'-[(E)-1-phenyl-ethyl-idene]propane-hydrazide. | Acta crystallographica. Section E, Structure reports online 20081201 |
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