Home Halogens N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide

N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide

CAS No.:
1156750-86-5
Catalog Number:
AG019SRI
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
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Product Description
Catalog Number:
AG019SRI
Chemical Name:
N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide
CAS Number:
1156750-86-5
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
MDL Number:
MFCD00594093
IUPAC Name:
N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide
InChI:
InChI=1S/C11H12ClNO3/c1-4-11(14)13-8-6-9(15-2)7(12)5-10(8)16-3/h4-6H,1H2,2-3H3,(H,13,14)
InChI Key:
GTYYMWHDASHQOO-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(cc1NC(=O)C=C)OC
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties