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2008-10-8 | 2,2'-(1,4-Butanediyl)bis-1,3-benzoxazole
CAS No: 2008-10-8 Catalog No: AG00BO15 MDL No:
Product Description
Catalog Number:
AG00BO15
Chemical Name:
2,2'-(1,4-Butanediyl)bis-1,3-benzoxazole
CAS Number:
2008-10-8
IUPAC Name:
2-[4-(1,3-benzoxazol-2-yl)butyl]-1,3-benzoxazole
InChI:
InChI=1S/C18H16N2O2/c1-3-9-15-13(7-1)19-17(21-15)11-5-6-12-18-20-14-8-2-4-10-16(14)22-18/h1-4,7-10H,5-6,11-12H2
InChI Key:
LNGWMLBHQIUQIX-UHFFFAOYSA-N
NSC Number:
105893
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.338g/mol
Monoisotopic Mass:
292.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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