Home Sulfos 3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate

3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate

CAS No.:
104530-80-5
Catalog Number:
AG0085VY
Molecular Formula:
C11H17NO4S
Molecular Weight:
259.3220
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Product Description
Catalog Number:
AG0085VY
Chemical Name:
3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate
CAS Number:
104530-80-5
Molecular Formula:
C11H17NO4S
Molecular Weight:
259.3220
MDL Number:
MFCD00066238
IUPAC Name:
4-methylbenzenesulfonic acid;(3S)-oxolan-3-amine
InChI:
InChI=1S/C7H8O3S.C4H9NO/c1-6-2-4-7(5-3-6)11(8,9)10;5-4-1-2-6-3-4/h2-5H,1H3,(H,8,9,10);4H,1-3,5H2/t;4-/m.0/s1
InChI Key:
BZXPLADBSZWDIH-VWMHFEHESA-N
SMILES:
N[C@@H]1COCC1.Cc1ccc(cc1)S(=O)(=O)O
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
259.088g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.32g/mol
Monoisotopic Mass:
259.088g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties