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197588-01-5 | Phenol, 4-[(triphenylmethyl)thio]-
CAS No: 197588-01-5 Catalog No: AG002AW7 MDL No:
Product Description
Catalog Number:
AG002AW7
Chemical Name:
Phenol, 4-[(triphenylmethyl)thio]-
CAS Number:
197588-01-5
Molecular Formula:
C25H20OS
Molecular Weight:
368.4907
IUPAC Name:
4-tritylsulfanylphenol
InChI:
InChI=1S/C25H20OS/c26-23-16-18-24(19-17-23)27-25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-19,26H
InChI Key:
HFYKRTCLQRSNOQ-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)SC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.123g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
368.494g/mol
Monoisotopic Mass:
368.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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