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Home Sulfos 2-methanesulfonyl-1,2,3,4-tetrahydroisoquinolin-5-amine

2-methanesulfonyl-1,2,3,4-tetrahydroisoquinolin-5-amine

CAS No.:
1179014-45-9
Catalog Number:
AG01A973
Molecular Formula:
C10H14N2O2S
Molecular Weight:
226.2954
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Product Description
Catalog Number:
AG01A973
Chemical Name:
2-methanesulfonyl-1,2,3,4-tetrahydroisoquinolin-5-amine
CAS Number:
1179014-45-9
Molecular Formula:
C10H14N2O2S
Molecular Weight:
226.2954
MDL Number:
MFCD12821604
IUPAC Name:
2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-5-amine
InChI:
InChI=1S/C10H14N2O2S/c1-15(13,14)12-6-5-9-8(7-12)3-2-4-10(9)11/h2-4H,5-7,11H2,1H3
InChI Key:
VBCCURKVUWPQQK-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1CCN(C2)S(=O)(=O)C
Properties
Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.078g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.294g/mol
Monoisotopic Mass:
226.078g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties