Home Other Building Blocks {[4,5-dimethoxy-2-(methylsulfanyl)phenyl]methyl}(methyl)amine

{[4,5-dimethoxy-2-(methylsulfanyl)phenyl]methyl}(methyl)amine

CAS No.:
1333889-03-4
Catalog Number:
AG01AKF5
Molecular Formula:
C11H17NO2S
Molecular Weight:
227.3232
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Product Description
Catalog Number:
AG01AKF5
Chemical Name:
{[4,5-dimethoxy-2-(methylsulfanyl)phenyl]methyl}(methyl)amine
CAS Number:
1333889-03-4
Molecular Formula:
C11H17NO2S
Molecular Weight:
227.3232
MDL Number:
MFCD20233469
IUPAC Name:
1-(4,5-dimethoxy-2-methylsulfanylphenyl)-N-methylmethanamine
InChI:
InChI=1S/C11H17NO2S/c1-12-7-8-5-9(13-2)10(14-3)6-11(8)15-4/h5-6,12H,7H2,1-4H3
InChI Key:
MDGZZRGMXCAYAE-UHFFFAOYSA-N
SMILES:
CNCc1cc(OC)c(cc1SC)OC
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.098g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.322g/mol
Monoisotopic Mass:
227.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties