Home Halogens 3-chloro-N-(3,4,5-trimethoxyphenyl)propanamide

3-chloro-N-(3,4,5-trimethoxyphenyl)propanamide

CAS No.:
91803-07-5
Catalog Number:
AG01A9KF
Molecular Formula:
C12H16ClNO4
Molecular Weight:
273.7127
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Product Description
Catalog Number:
AG01A9KF
Chemical Name:
3-chloro-N-(3,4,5-trimethoxyphenyl)propanamide
CAS Number:
91803-07-5
Molecular Formula:
C12H16ClNO4
Molecular Weight:
273.7127
MDL Number:
MFCD00524921
IUPAC Name:
3-chloro-N-(3,4,5-trimethoxyphenyl)propanamide
InChI:
InChI=1S/C12H16ClNO4/c1-16-9-6-8(14-11(15)4-5-13)7-10(17-2)12(9)18-3/h6-7H,4-5H2,1-3H3,(H,14,15)
InChI Key:
PDNUCPADTCCWPQ-UHFFFAOYSA-N
SMILES:
ClCCC(=O)Nc1cc(OC)c(c(c1)OC)OC
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.077g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.713g/mol
Monoisotopic Mass:
273.077g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties