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881-48-1 | Urea,N-(2-cyanoethyl)-N-cyclohexyl-
CAS No: 881-48-1 Catalog No: AG004D7T MDL No:
Product Description
Catalog Number:
AG004D7T
Chemical Name:
Urea,N-(2-cyanoethyl)-N-cyclohexyl-
CAS Number:
881-48-1
Molecular Formula:
C10H17N3O
Molecular Weight:
195.2615
IUPAC Name:
1-(2-cyanoethyl)-1-cyclohexylurea
InChI:
InChI=1S/C10H17N3O/c11-7-4-8-13(10(12)14)9-5-2-1-3-6-9/h9H,1-6,8H2,(H2,12,14)
InChI Key:
IVACNLAJPODRBE-UHFFFAOYSA-N
SMILES:
N#CCCN(C(=O)N)C1CCCCC1
NSC Number:
67077
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.266g/mol
Monoisotopic Mass:
195.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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