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43115-21-5 | 2,2'-(naphthalene-1,4-diyl)bis[5-(ethylsulphonyl)benzoxazole]
CAS No: 43115-21-5 Catalog No: AG00E35P MDL No:
Product Description
Catalog Number:
AG00E35P
Chemical Name:
2,2'-(naphthalene-1,4-diyl)bis[5-(ethylsulphonyl)benzoxazole]
CAS Number:
43115-21-5
IUPAC Name:
5-ethylsulfonyl-2-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)naphthalen-1-yl]-1,3-benzoxazole
InChI:
InChI=1S/C28H22N2O6S2/c1-3-37(31,32)17-9-13-25-23(15-17)29-27(35-25)21-11-12-22(20-8-6-5-7-19(20)21)28-30-24-16-18(38(33,34)4-2)10-14-26(24)36-28/h5-16H,3-4H2,1-2H3
InChI Key:
VKMDEOVMXQHORY-UHFFFAOYSA-N
EC Number:
256-099-8
Properties
Complexity:
972
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
546.092g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
546.612g/mol
Monoisotopic Mass:
546.092g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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