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13908-28-6 | Urea, N-(2-chloroethyl)-N'-cyclooctyl-
CAS No: 13908-28-6 Catalog No: AG001A6C MDL No:
Product Description
Catalog Number:
AG001A6C
Chemical Name:
Urea, N-(2-chloroethyl)-N'-cyclooctyl-
CAS Number:
13908-28-6
Molecular Formula:
C11H21ClN2O
Molecular Weight:
232.7502
IUPAC Name:
1-(2-chloroethyl)-3-cyclooctylurea
InChI:
InChI=1S/C11H21ClN2O/c12-8-9-13-11(15)14-10-6-4-2-1-3-5-7-10/h10H,1-9H2,(H2,13,14,15)
InChI Key:
NXAQIGSRKKTKQI-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NC1CCCCCCC1
NSC Number:
91739
Properties
Complexity:
179
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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