Benzenemethanol, 4-(phenylthio)-


Chemical Name: Benzenemethanol, 4-(phenylthio)-
CAS Number: 6317-56-2
Product Number: AG00E8P4(AGN-PC-0JLSQT)
Synonyms:
MDL No:
Molecular Formula: C13H12OS
Molecular Weight: 216.2988

Identification/Properties


Computed Properties
Molecular Weight:
216.298g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
216.061g/mol
Monoisotopic Mass:
216.061g/mol
Topological Polar Surface Area:
45.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
169
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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