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Home > Nitro Compounds > 100253-83-6
100253-83-6 | Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-
CAS No: 100253-83-6 Catalog No: AG0001E8 MDL No:
Product Description
Catalog Number:
AG0001E8
Chemical Name:
Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-
CAS Number:
100253-83-6
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
IUPAC Name:
N-benzyl-2,2-dimethyl-N-nitrosopropanamide
InChI:
InChI=1S/C12H16N2O2/c1-12(2,3)11(15)14(13-16)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChI Key:
AKNHXSGWJZXTJG-UHFFFAOYSA-N
SMILES:
O=NN(C(=O)C(C)(C)C)Cc1ccccc1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Boundary conditions on the partitioning of deaminatively generated benzyl cations. | The Journal of organic chemistry 20010420 |
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