200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 83781-02-6
83781-02-6 | (1,5-Dimethylhexyl)ammonium (1S)-2-oxobornane-10-sulphonate
CAS No: 83781-02-6 Catalog No: AG004SLY MDL No:
Product Description
Catalog Number:
AG004SLY
Chemical Name:
(1,5-Dimethylhexyl)ammonium (1S)-2-oxobornane-10-sulphonate
CAS Number:
83781-02-6
Molecular Formula:
C18H35NO4S
Molecular Weight:
361.5398
IUPAC Name:
(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methanesulfonate;[(2S)-6-methylheptan-2-yl]azanium
InChI:
InChI=1S/C10H16O4S.C8H19N/c1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14;1-7(2)5-4-6-8(3)9/h7H,3-6H2,1-2H3,(H,12,13,14);7-8H,4-6,9H2,1-3H3/t;8-/m.0/s1
InChI Key:
IJUZWPVVLRFXDI-WDBKTSHHSA-N
SMILES:
O=C1CC2C([C@]1(CC2)CS(=O)(=O)[O-])(C)C.CC(CCCC([NH3+])C)C
EC Number:
280-779-3
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
361.229g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
361.541g/mol
Monoisotopic Mass:
361.229g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Related Products
© 2019 Angene International Limited. All rights Reserved.