Home Other Building Blocks 4-{[4-(propan-2-yl)phenyl]sulfanyl}aniline

4-{[4-(propan-2-yl)phenyl]sulfanyl}aniline

CAS No.:
62248-50-4
Catalog Number:
AG01A8M2
Molecular Formula:
C15H17NS
Molecular Weight:
243.3672
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Product Description
Catalog Number:
AG01A8M2
Chemical Name:
4-{[4-(propan-2-yl)phenyl]sulfanyl}aniline
CAS Number:
62248-50-4
Molecular Formula:
C15H17NS
Molecular Weight:
243.3672
MDL Number:
MFCD11117353
IUPAC Name:
4-(4-propan-2-ylphenyl)sulfanylaniline
InChI:
InChI=1S/C15H17NS/c1-11(2)12-3-7-14(8-4-12)17-15-9-5-13(16)6-10-15/h3-11H,16H2,1-2H3
InChI Key:
SIIBXVIBBSAWCM-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)Sc1ccc(cc1)C(C)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.108g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.368g/mol
Monoisotopic Mass:
243.108g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties