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68099-10-5

68099-10-5 | Ethanethione, 1-(4-methylphenyl)-

CAS No: 68099-10-5 Catalog No: AG006FZL MDL No:

Product Description

Catalog Number:
AG006FZL
Chemical Name:
Ethanethione, 1-(4-methylphenyl)-
CAS Number:
68099-10-5
Molecular Formula:
C9H10S
Molecular Weight:
150.2407
IUPAC Name:
1-(4-methylphenyl)ethanethione
InChI:
InChI=1S/C9H10S/c1-7-3-5-9(6-4-7)8(2)10/h3-6H,1-2H3
InChI Key:
JYPHLPNETPCWMY-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=S)C

Properties

Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.05g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.239g/mol
Monoisotopic Mass:
150.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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