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416859-97-7 | 4-(4-phenyl-1,3-thiazol-2-yl)phenol
CAS No: 416859-97-7 Catalog No: AG01A7IW MDL No:MFCD01849218
Product Description
Catalog Number:
AG01A7IW
Chemical Name:
4-(4-phenyl-1,3-thiazol-2-yl)phenol
CAS Number:
416859-97-7
Molecular Formula:
C15H11NOS
Molecular Weight:
253.3189
MDL Number:
MFCD01849218
IUPAC Name:
4-(4-phenyl-1,3-thiazol-2-yl)phenol
InChI:
InChI=1S/C15H11NOS/c17-13-8-6-12(7-9-13)15-16-14(10-18-15)11-4-2-1-3-5-11/h1-10,17H
InChI Key:
DKXVVPYNEPDZNT-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1scc(n1)c1ccccc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.319g/mol
Monoisotopic Mass:
253.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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