Home Other Building Blocks [1-(4-methanesulfinylphenyl)ethyl](methyl)amine

[1-(4-methanesulfinylphenyl)ethyl](methyl)amine

CAS No.:
1375472-47-1
Catalog Number:
AG019TFF
Molecular Formula:
C10H15NOS
Molecular Weight:
197.2972
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Product Description
Catalog Number:
AG019TFF
Chemical Name:
[1-(4-methanesulfinylphenyl)ethyl](methyl)amine
CAS Number:
1375472-47-1
Molecular Formula:
C10H15NOS
Molecular Weight:
197.2972
MDL Number:
MFCD21602612
IUPAC Name:
N-methyl-1-(4-methylsulfinylphenyl)ethanamine
InChI:
InChI=1S/C10H15NOS/c1-8(11-2)9-4-6-10(7-5-9)13(3)12/h4-8,11H,1-3H3
InChI Key:
SCSJPBNMIUJMPJ-UHFFFAOYSA-N
SMILES:
CNC(c1ccc(cc1)S(=O)C)C
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.087g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.296g/mol
Monoisotopic Mass:
197.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties