Home Aldehydes 4-(Benzylsulfanyl)benzaldehyde

4-(Benzylsulfanyl)benzaldehyde

CAS No.:
78832-95-8
Catalog Number:
AG005P4G
Molecular Formula:
C14H12OS
Molecular Weight:
228.3095
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$119
- +
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1050
- +
10g
98%
In Stock USA
United States
$1400
- +
Product Description
Catalog Number:
AG005P4G
Chemical Name:
4-(Benzylsulfanyl)benzaldehyde
CAS Number:
78832-95-8
Molecular Formula:
C14H12OS
Molecular Weight:
228.3095
MDL Number:
MFCD18887727
IUPAC Name:
4-benzylsulfanylbenzaldehyde
InChI:
InChI=1S/C14H12OS/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2
InChI Key:
NAEZWYYYMVTEIV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)SCc1ccccc1
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.061g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.309g/mol
Monoisotopic Mass:
228.061g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
4,6-Bis[4-(benzyl-sulfan-yl)styr-yl]-2-(methyl-sulfan-yl)pyrimidine. Acta crystallographica. Section E, Structure reports online 20080101
Properties