Home Sulfos (1-cyanocyclohexyl)methyl methanesulfonate

(1-cyanocyclohexyl)methyl methanesulfonate

CAS No.:
1268101-90-1
Catalog Number:
AG01C3LA
Molecular Formula:
C9H15NO3S
Molecular Weight:
217.2853
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Product Description
Catalog Number:
AG01C3LA
Chemical Name:
(1-cyanocyclohexyl)methyl methanesulfonate
CAS Number:
1268101-90-1
Molecular Formula:
C9H15NO3S
Molecular Weight:
217.2853
MDL Number:
MFCD19317706
IUPAC Name:
(1-cyanocyclohexyl)methyl methanesulfonate
InChI:
InChI=1S/C9H15NO3S/c1-14(11,12)13-8-9(7-10)5-3-2-4-6-9/h2-6,8H2,1H3
InChI Key:
CSNZAYIVGCVEPN-UHFFFAOYSA-N
SMILES:
N#CC1(CCCCC1)COS(=O)(=O)C
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.077g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.283g/mol
Monoisotopic Mass:
217.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties