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53392-47-5 | Diphenylmethanethiol acetate
CAS No: 53392-47-5 Catalog No: AG003PPS MDL No:
Product Description
Catalog Number:
AG003PPS
Chemical Name:
Diphenylmethanethiol acetate
CAS Number:
53392-47-5
IUPAC Name:
acetic acid;diphenylmethanethiol
InChI:
InChI=1S/C13H12S.C2H4O2/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2(3)4/h1-10,13-14H;1H3,(H,3,4)
InChI Key:
GDVBXJQNEUMMSC-UHFFFAOYSA-N
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.087g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.351g/mol
Monoisotopic Mass:
260.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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