Home Other Building Blocks 2-(azepan-1-yl)cyclohexan-1-one

2-(azepan-1-yl)cyclohexan-1-one

CAS No.:
1157735-52-8
Catalog Number:
AG019U5V
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
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Product Description
Catalog Number:
AG019U5V
Chemical Name:
2-(azepan-1-yl)cyclohexan-1-one
CAS Number:
1157735-52-8
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
MDL Number:
MFCD12059241
IUPAC Name:
2-(azepan-1-yl)cyclohexan-1-one
InChI:
InChI=1S/C12H21NO/c14-12-8-4-3-7-11(12)13-9-5-1-2-6-10-13/h11H,1-10H2
InChI Key:
IJRYZNMWTAVFKX-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1N1CCCCCC1
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.162g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.306g/mol
Monoisotopic Mass:
195.162g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties