Home Other Building Blocks Benzene, (propylthio)-

Benzene, (propylthio)-

CAS No.:
874-79-3
Catalog Number:
AG004FN2
Molecular Formula:
C9H12S
Molecular Weight:
152.2566
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
99%
1 week
United States
$80
- +
1g
99%
1 week
United States
$121
- +
5g
99%
1 week
United States
$288
- +
25g
99%
1 week
United States
$677
- +
Product Description
Catalog Number:
AG004FN2
Chemical Name:
Benzene, (propylthio)-
CAS Number:
874-79-3
Molecular Formula:
C9H12S
Molecular Weight:
152.2566
MDL Number:
MFCD00039936
IUPAC Name:
propylsulfanylbenzene
InChI:
InChI=1S/C9H12S/c1-2-8-10-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChI Key:
NWYDLOBJQIJDGH-UHFFFAOYSA-N
SMILES:
CCCSc1ccccc1
NSC Number:
115079
Properties
Complexity:
74.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.066g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.255g/mol
Monoisotopic Mass:
152.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
[3-Meth-oxy-1-(phenyl-sulfan-yl)prop-yl]triphenyl-tin(IV) benzene 0.17-solvate. Acta crystallographica. Section E, Structure reports online 20120201
Properties