Home Other Building Blocks 4-(cyclohexylsulfanyl)-2-methylaniline

4-(cyclohexylsulfanyl)-2-methylaniline

CAS No.:
1178225-23-4
Catalog Number:
AG01A8BQ
Molecular Formula:
C13H19NS
Molecular Weight:
221.3617
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Product Description
Catalog Number:
AG01A8BQ
Chemical Name:
4-(cyclohexylsulfanyl)-2-methylaniline
CAS Number:
1178225-23-4
Molecular Formula:
C13H19NS
Molecular Weight:
221.3617
MDL Number:
MFCD12801138
IUPAC Name:
4-cyclohexylsulfanyl-2-methylaniline
InChI:
InChI=1S/C13H19NS/c1-10-9-12(7-8-13(10)14)15-11-5-3-2-4-6-11/h7-9,11H,2-6,14H2,1H3
InChI Key:
OOGYGQCVDMVGCA-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C)SC1CCCCC1
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.124g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.362g/mol
Monoisotopic Mass:
221.124g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties