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144205-34-5

144205-34-5 | Acetamide, N-[5-nitro-2-(1,1,3,3-tetramethylbutoxy)phenyl]-

CAS No: 144205-34-5 Catalog No: AG001J3W MDL No:

Product Description

Catalog Number:
AG001J3W
Chemical Name:
Acetamide, N-[5-nitro-2-(1,1,3,3-tetramethylbutoxy)phenyl]-
CAS Number:
144205-34-5
Molecular Formula:
C16H24N2O4
Molecular Weight:
308.3728
IUPAC Name:
N-[5-nitro-2-(2,4,4-trimethylpentan-2-yloxy)phenyl]acetamide
InChI:
InChI=1S/C16H24N2O4/c1-11(19)17-13-9-12(18(20)21)7-8-14(13)22-16(5,6)10-15(2,3)4/h7-9H,10H2,1-6H3,(H,17,19)
InChI Key:
XTUABMMFNJJQGG-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(ccc1OC(CC(C)(C)C)(C)C)[N+](=O)[O-]

Properties

Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.174g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.378g/mol
Monoisotopic Mass:
308.174g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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