Home Sulfos ammonium [(1R,3S,4S)-3-bromo-1,7-dimethyl-2-oxobicyclo[2.2.1]heptan-7-yl]methanesulfonate

ammonium [(1R,3S,4S)-3-bromo-1,7-dimethyl-2-oxobicyclo[2.2.1]heptan-7-yl]methanesulfonate

CAS No.:
1262985-34-1
Catalog Number:
AG01B52T
Molecular Formula:
C10H18BrNO4S
Molecular Weight:
328.2232
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Product Description
Catalog Number:
AG01B52T
Chemical Name:
ammonium [(1R,3S,4S)-3-bromo-1,7-dimethyl-2-oxobicyclo[2.2.1]heptan-7-yl]methanesulfonate
CAS Number:
1262985-34-1
Molecular Formula:
C10H18BrNO4S
Molecular Weight:
328.2232
MDL Number:
MFCD00151191
IUPAC Name:
azanium;[(1R,4R)-3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl]methanesulfonate
InChI:
InChI=1S/C10H15BrO4S.H3N/c1-9-4-3-6(7(11)8(9)12)10(9,2)5-16(13,14)15;/h6-7H,3-5H2,1-2H3,(H,13,14,15);1H3/t6-,7?,9-,10?;/m0./s1
InChI Key:
GFBVBBRNPGPROZ-UEYTUOTFSA-N
SMILES:
Br[C@@H]1C(=O)[C@]2(C([C@@H]1CC2)(C)CS(=O)(=O)[O-])C.[NH4+]
Properties
Complexity:
427  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
327.014g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
328.221g/mol
Monoisotopic Mass:
327.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties