Home Aldehydes 2,5-Dimethoxy-4-(methylthio)benzaldehyde

2,5-Dimethoxy-4-(methylthio)benzaldehyde

CAS No.:
61638-04-8
Catalog Number:
AG00EEDG
Molecular Formula:
C10H12O3S
Molecular Weight:
212.2655
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG00EEDG
Chemical Name:
2,5-Dimethoxy-4-(methylthio)benzaldehyde
CAS Number:
61638-04-8
Molecular Formula:
C10H12O3S
Molecular Weight:
212.2655
MDL Number:
MFCD00010653
IUPAC Name:
2,5-dimethoxy-4-methylsulfanylbenzaldehyde
InChI:
InChI=1S/C10H12O3S/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3
InChI Key:
IRQXDQKWXGOSEM-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(cc1SC)OC
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.263g/mol
Monoisotopic Mass:
212.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties