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88723-26-6

88723-26-6 | Ethanone, 1-[2-(cyclohexylamino)-1H-imidazol-4-yl]-

CAS No: 88723-26-6 Catalog No: AG0045TC MDL No:

Product Description

Catalog Number:
AG0045TC
Chemical Name:
Ethanone, 1-[2-(cyclohexylamino)-1H-imidazol-4-yl]-
CAS Number:
88723-26-6
Molecular Formula:
C11H17N3O
Molecular Weight:
207.2722
IUPAC Name:
1-[2-(cyclohexylamino)-1H-imidazol-5-yl]ethanone
InChI:
InChI=1S/C11H17N3O/c1-8(15)10-7-12-11(14-10)13-9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,12,13,14)
InChI Key:
AFANMFBDGRMPGD-UHFFFAOYSA-N
SMILES:
CC(=O)c1nc([nH]c1)NC1CCCCC1

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.137g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.277g/mol
Monoisotopic Mass:
207.137g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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