200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 115217-25-9
115217-25-9 | Ethanone, 2-(hexahydro-1(2H)-azocinyl)-1-phenyl-
CAS No: 115217-25-9 Catalog No: AG000GH8 MDL No:
Product Description
Catalog Number:
AG000GH8
Chemical Name:
Ethanone, 2-(hexahydro-1(2H)-azocinyl)-1-phenyl-
CAS Number:
115217-25-9
Molecular Formula:
C15H21NO
Molecular Weight:
231.3333
IUPAC Name:
2-(azocan-1-yl)-1-phenylethanone
InChI:
InChI=1S/C15H21NO/c17-15(14-9-5-4-6-10-14)13-16-11-7-2-1-3-8-12-16/h4-6,9-10H,1-3,7-8,11-13H2
InChI Key:
KBZCCBFHGHXNNC-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CN1CCCCCCC1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.162g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.339g/mol
Monoisotopic Mass:
231.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.