Home Halogens 1-(2H-1,3-benzodioxol-5-yl)-3-(2-chloroacetyl)urea

1-(2H-1,3-benzodioxol-5-yl)-3-(2-chloroacetyl)urea

CAS No.:
871673-27-7
Catalog Number:
AG019OS3
Molecular Formula:
C10H9ClN2O4
Molecular Weight:
256.6425
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Product Description
Catalog Number:
AG019OS3
Chemical Name:
1-(2H-1,3-benzodioxol-5-yl)-3-(2-chloroacetyl)urea
CAS Number:
871673-27-7
Molecular Formula:
C10H9ClN2O4
Molecular Weight:
256.6425
MDL Number:
MFCD07355839
IUPAC Name:
N-(1,3-benzodioxol-5-ylcarbamoyl)-2-chloroacetamide
InChI:
InChI=1S/C10H9ClN2O4/c11-4-9(14)13-10(15)12-6-1-2-7-8(3-6)17-5-16-7/h1-3H,4-5H2,(H2,12,13,14,15)
InChI Key:
YOYYUOUKNAYOFU-UHFFFAOYSA-N
SMILES:
ClCC(=O)NC(=O)Nc1ccc2c(c1)OCO2
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.025g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.642g/mol
Monoisotopic Mass:
256.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties