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102433-42-1

102433-42-1 | Urea, N-(2-chloroethyl)-N'-(3,5-dimethylcyclohexyl)-

CAS No: 102433-42-1 Catalog No: AG0007GN MDL No:

Product Description

Catalog Number:
AG0007GN
Chemical Name:
Urea, N-(2-chloroethyl)-N'-(3,5-dimethylcyclohexyl)-
CAS Number:
102433-42-1
Molecular Formula:
C11H21ClN2O
Molecular Weight:
232.7502
IUPAC Name:
1-(2-chloroethyl)-3-(3,5-dimethylcyclohexyl)urea
InChI:
InChI=1S/C11H21ClN2O/c1-8-5-9(2)7-10(6-8)14-11(15)13-4-3-12/h8-10H,3-7H2,1-2H3,(H2,13,14,15)
InChI Key:
MJSGXGRBDSTGNJ-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NC1CC(C)CC(C1)C
NSC Number:
162084

Properties

Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.134g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.752g/mol
Monoisotopic Mass:
232.134g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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