200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 46471-67-4
46471-67-4 | methyl {7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl}methanesulfonate
CAS No: 46471-67-4 Catalog No: AG01B1UJ MDL No:MFCD30180397
Product Description
Catalog Number:
AG01B1UJ
Chemical Name:
methyl {7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl}methanesulfonate
CAS Number:
46471-67-4
Molecular Formula:
C11H18O4S
Molecular Weight:
246.3232
MDL Number:
MFCD30180397
IUPAC Name:
methyl (7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methanesulfonate
InChI:
InChI=1S/C11H18O4S/c1-10(2)8-4-5-11(10,9(12)6-8)7-16(13,14)15-3/h8H,4-7H2,1-3H3
InChI Key:
PIZJIRRXGXBJAU-UHFFFAOYSA-N
SMILES:
COS(=O)(=O)CC12CCC(C2(C)C)CC1=O
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.093g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.321g/mol
Monoisotopic Mass:
246.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.