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84257-51-2

84257-51-2 | Acetamide, N-[3-methyl-4-(2-nitro-1-propenyl)phenyl]-

CAS No: 84257-51-2 Catalog No: AG004YPW MDL No:

Product Description

Catalog Number:
AG004YPW
Chemical Name:
Acetamide, N-[3-methyl-4-(2-nitro-1-propenyl)phenyl]-
CAS Number:
84257-51-2
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
IUPAC Name:
N-[3-methyl-4-(2-nitroprop-1-enyl)phenyl]acetamide
InChI:
InChI=1S/C12H14N2O3/c1-8-6-12(13-10(3)15)5-4-11(8)7-9(2)14(16)17/h4-7H,1-3H3,(H,13,15)
InChI Key:
RLBDKMRDLTXDCP-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c(c1)C)C=C([N+](=O)[O-])C

Properties

Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.255g/mol
Monoisotopic Mass:
234.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.4  

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