Home Halogens 3-(2-chloroethyl)-1-(propan-2-yl)urea

3-(2-chloroethyl)-1-(propan-2-yl)urea

CAS No.:
883805-52-5
Catalog Number:
AG01C47K
Molecular Formula:
C6H13ClN2O
Molecular Weight:
164.6332
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Product Description
Catalog Number:
AG01C47K
Chemical Name:
3-(2-chloroethyl)-1-(propan-2-yl)urea
CAS Number:
883805-52-5
Molecular Formula:
C6H13ClN2O
Molecular Weight:
164.6332
MDL Number:
MFCD02671060
IUPAC Name:
1-(2-chloroethyl)-3-propan-2-ylurea
InChI:
InChI=1S/C6H13ClN2O/c1-5(2)9-6(10)8-4-3-7/h5H,3-4H2,1-2H3,(H2,8,9,10)
InChI Key:
ZKOVNWYVGDBEKU-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NC(C)C
Properties
Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.072g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
164.633g/mol
Monoisotopic Mass:
164.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties