Home Other Building Blocks 2-(benzylsulfanyl)propanedial

2-(benzylsulfanyl)propanedial

CAS No.:
1311318-08-7
Catalog Number:
AG01A90U
Molecular Formula:
C10H10O2S
Molecular Weight:
194.2502
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A90U
Chemical Name:
2-(benzylsulfanyl)propanedial
CAS Number:
1311318-08-7
Molecular Formula:
C10H10O2S
Molecular Weight:
194.2502
MDL Number:
MFCD18917238
IUPAC Name:
2-benzylsulfanylpropanedial
InChI:
InChI=1S/C10H10O2S/c11-6-10(7-12)13-8-9-4-2-1-3-5-9/h1-7,10H,8H2
InChI Key:
DSMBXUISKUJZGG-UHFFFAOYSA-N
SMILES:
O=CC(C=O)SCc1ccccc1
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.248g/mol
Monoisotopic Mass:
194.04g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties