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40265-60-9 | 2,3-Dimethyl-5-phenylbenzoxazole-3-ium
CAS No: 40265-60-9 Catalog No: AG00CV6T MDL No:
Product Description
Catalog Number:
AG00CV6T
Chemical Name:
2,3-Dimethyl-5-phenylbenzoxazole-3-ium
CAS Number:
40265-60-9
IUPAC Name:
2,3-dimethyl-5-phenyl-1,3-benzoxazol-3-ium
InChI:
InChI=1S/C15H14NO/c1-11-16(2)14-10-13(8-9-15(14)17-11)12-6-4-3-5-7-12/h3-10H,1-2H3/q+1
InChI Key:
MUONPSGCTQKTRZ-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.108g/mol
Formal Charge:
1
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.283g/mol
Monoisotopic Mass:
224.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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