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150368-30-2 | [1,1'-Biphenyl]-4-ol, 2'-(2H-tetrazol-5-yl)-
CAS No: 150368-30-2 Catalog No: AG001MK2 MDL No:
Product Description
Catalog Number:
AG001MK2
Chemical Name:
[1,1'-Biphenyl]-4-ol, 2'-(2H-tetrazol-5-yl)-
CAS Number:
150368-30-2
Molecular Formula:
C13H10N4O
Molecular Weight:
238.2447
IUPAC Name:
4-[2-(2H-tetrazol-5-yl)phenyl]phenol
InChI:
InChI=1S/C13H10N4O/c18-10-7-5-9(6-8-10)11-3-1-2-4-12(11)13-14-16-17-15-13/h1-8,18H,(H,14,15,16,17)
InChI Key:
AGAGBJLFXRVHGJ-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1ccccc1c1nn[nH]n1
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.25g/mol
Monoisotopic Mass:
238.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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