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102433-39-6

102433-39-6 | Urea, N-(2-chloroethyl)-N'-(2,5-dimethoxyphenyl)-

CAS No: 102433-39-6 Catalog No: AG0007GP MDL No:

Product Description

Catalog Number:
AG0007GP
Chemical Name:
Urea, N-(2-chloroethyl)-N'-(2,5-dimethoxyphenyl)-
CAS Number:
102433-39-6
Molecular Formula:
C11H15ClN2O3
Molecular Weight:
258.7014
IUPAC Name:
1-(2-chloroethyl)-3-(2,5-dimethoxyphenyl)urea
InChI:
InChI=1S/C11H15ClN2O3/c1-16-8-3-4-10(17-2)9(7-8)14-11(15)13-6-5-12/h3-4,7H,5-6H2,1-2H3,(H2,13,14,15)
InChI Key:
ATOSFFSYPUQKHR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1NC(=O)NCCCl)OC
NSC Number:
160106

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.702g/mol
Monoisotopic Mass:
258.077g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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