5-chloro-2-methyl-benzenethiol


Chemical Name: 5-chloro-2-methyl-benzenethiol
CAS Number: 18858-06-5
Product Number: AG002H0P(AGN-PC-0JNVLE)
Synonyms:
MDL No:
Molecular Formula: C7H7ClS
Molecular Weight: 158.6485

Identification/Properties


Computed Properties
Molecular Weight:
158.643g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
157.996g/mol
Monoisotopic Mass:
157.996g/mol
Topological Polar Surface Area:
1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
94.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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