Home Other Building Blocks 1-[2-(methylsulfanyl)phenyl]propan-2-one

1-[2-(methylsulfanyl)phenyl]propan-2-one

CAS No.:
27350-24-9
Catalog Number:
AG01A68T
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A68T
Chemical Name:
1-[2-(methylsulfanyl)phenyl]propan-2-one
CAS Number:
27350-24-9
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
MDL Number:
MFCD25371746
IUPAC Name:
1-(2-methylsulfanylphenyl)propan-2-one
InChI:
InChI=1S/C10H12OS/c1-8(11)7-9-5-3-4-6-10(9)12-2/h3-6H,7H2,1-2H3
InChI Key:
ZVGPMCFSHYYVBH-UHFFFAOYSA-N
SMILES:
CSc1ccccc1CC(=O)C
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.061g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.265g/mol
Monoisotopic Mass:
180.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties