Home Halogens Propane, 1-chloro-3-(methylthio)-

Propane, 1-chloro-3-(methylthio)-

CAS No.:
13012-59-4
Catalog Number:
AG000U1H
Molecular Formula:
C4H9ClS
Molecular Weight:
124.6323
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Product Description
Catalog Number:
AG000U1H
Chemical Name:
Propane, 1-chloro-3-(methylthio)-
CAS Number:
13012-59-4
Molecular Formula:
C4H9ClS
Molecular Weight:
124.6323
MDL Number:
MFCD12823570
IUPAC Name:
1-chloro-3-methylsulfanylpropane
InChI:
InChI=1S/C4H9ClS/c1-6-4-2-3-5/h2-4H2,1H3
InChI Key:
RAVGOEYQXCTKGT-UHFFFAOYSA-N
SMILES:
CSCCCCl
Properties
Complexity:
23.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.011g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.626g/mol
Monoisotopic Mass:
124.011g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties