Home Halogens 3-bromo-N-[(2,4-dimethoxyphenyl)methyl]propanamide

3-bromo-N-[(2,4-dimethoxyphenyl)methyl]propanamide

CAS No.:
1864057-40-8
Catalog Number:
AG01AP3K
Molecular Formula:
C12H16BrNO3
Molecular Weight:
302.1643
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Product Description
Catalog Number:
AG01AP3K
Chemical Name:
3-bromo-N-[(2,4-dimethoxyphenyl)methyl]propanamide
CAS Number:
1864057-40-8
Molecular Formula:
C12H16BrNO3
Molecular Weight:
302.1643
MDL Number:
MFCD26359927
IUPAC Name:
3-bromo-N-[(2,4-dimethoxyphenyl)methyl]propanamide
InChI:
InChI=1S/C12H16BrNO3/c1-16-10-4-3-9(11(7-10)17-2)8-14-12(15)5-6-13/h3-4,7H,5-6,8H2,1-2H3,(H,14,15)
InChI Key:
ZJSRKXXWAINJSU-UHFFFAOYSA-N
SMILES:
BrCCC(=O)NCc1ccc(cc1OC)OC
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.031g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
302.168g/mol
Monoisotopic Mass:
301.031g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties