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4763-79-5 | 4-[2-[4-(2-benzoxazoleyl)phenyl]vinyl]benzoic acid
CAS No: 4763-79-5 Catalog No: AG00DOAM MDL No:
Product Description
Catalog Number:
AG00DOAM
Chemical Name:
4-[2-[4-(2-benzoxazoleyl)phenyl]vinyl]benzoic acid
CAS Number:
4763-79-5
IUPAC Name:
4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoic acid
InChI:
InChI=1S/C22H15NO3/c24-22(25)18-13-9-16(10-14-18)6-5-15-7-11-17(12-8-15)21-23-19-3-1-2-4-20(19)26-21/h1-14H,(H,24,25)/b6-5+
InChI Key:
LKYXNMIEWBYPGZ-AATRIKPKSA-N
EC Number:
225-303-7
Properties
Complexity:
504
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
341.105g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
341.366g/mol
Monoisotopic Mass:
341.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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