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

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

CAS No.:
1384429-00-8
Catalog Number:
AG019YYQ
Molecular Formula:
C12H22ClNO
Molecular Weight:
231.7622
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Product Description
Catalog Number:
AG019YYQ
Chemical Name:
2-(azepan-2-yl)cyclohexan-1-one hydrochloride
CAS Number:
1384429-00-8
Molecular Formula:
C12H22ClNO
Molecular Weight:
231.7622
MDL Number:
MFCD22369818
IUPAC Name:
2-(azepan-2-yl)cyclohexan-1-one;hydrochloride
InChI:
InChI=1S/C12H21NO.ClH/c14-12-8-4-3-6-10(12)11-7-2-1-5-9-13-11;/h10-11,13H,1-9H2;1H
InChI Key:
LUOXFDQAEHLHDC-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1C1CCCCCN1.Cl
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.139g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.764g/mol
Monoisotopic Mass:
231.139g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties