Home Aminos 3-(Dimethylamino)-1-(4-nitrophenyl)prop-2-en-1-one

3-(Dimethylamino)-1-(4-nitrophenyl)prop-2-en-1-one

CAS No.:
68760-11-2
Catalog Number:
AG00FH6Q
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
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Product Description
Catalog Number:
AG00FH6Q
Chemical Name:
3-(Dimethylamino)-1-(4-nitrophenyl)prop-2-en-1-one
CAS Number:
68760-11-2
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD00121191
IUPAC Name:
(E)-3-(dimethylamino)-1-(4-nitrophenyl)prop-2-en-1-one
InChI:
InChI=1S/C11H12N2O3/c1-12(2)8-7-11(14)9-3-5-10(6-4-9)13(15)16/h3-8H,1-2H3/b8-7+
InChI Key:
LIOPOMJNIUNMRH-BQYQJAHWSA-N
SMILES:
CN(C=CC(=O)c1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties