Home Aldehydes 2-((4-methoxyphenyl)thio)acetaldehyde

2-((4-methoxyphenyl)thio)acetaldehyde

CAS No.:
105126-90-7
Catalog Number:
AG01BIE9
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BIE9
Chemical Name:
2-((4-methoxyphenyl)thio)acetaldehyde
CAS Number:
105126-90-7
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
MDL Number:
MFCD11585672
IUPAC Name:
2-(4-methoxyphenyl)sulfanylacetaldehyde
InChI:
InChI=1S/C9H10O2S/c1-11-8-2-4-9(5-3-8)12-7-6-10/h2-6H,7H2,1H3
InChI Key:
MXHISBNGLWMWFO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)SCC=O
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.04g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.237g/mol
Monoisotopic Mass:
182.04g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties