200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 13756-93-9
13756-93-9 | Cyclohexanone, 2-methyl-2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-
CAS No: 13756-93-9 Catalog No: AG0013KT MDL No:
Product Description
Catalog Number:
AG0013KT
Chemical Name:
Cyclohexanone, 2-methyl-2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-
CAS Number:
13756-93-9
Molecular Formula:
C15H20O4S
Molecular Weight:
296.3819
IUPAC Name:
(1-methyl-2-oxocyclohexyl)methyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C15H20O4S/c1-12-6-8-13(9-7-12)20(17,18)19-11-15(2)10-4-3-5-14(15)16/h6-9H,3-5,10-11H2,1-2H3
InChI Key:
RIJHMWFBDNMAFI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)OCC1(C)CCCCC1=O
NSC Number:
134286
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.108g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.381g/mol
Monoisotopic Mass:
296.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.