Home Aldehydes 4-(Isopropylsulfanyl)benzaldehyde

4-(Isopropylsulfanyl)benzaldehyde

CAS No.:
84264-99-3
Catalog Number:
AG004YPL
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG004YPL
Chemical Name:
4-(Isopropylsulfanyl)benzaldehyde
CAS Number:
84264-99-3
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
MDL Number:
MFCD18887933
IUPAC Name:
4-propan-2-ylsulfanylbenzaldehyde
InChI:
InChI=1S/C10H12OS/c1-8(2)12-10-5-3-9(7-11)4-6-10/h3-8H,1-2H3
InChI Key:
SIPXRBLFWCFUIE-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)SC(C)C
Properties
Complexity:
137  
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:
2.7  
Properties