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881-60-7 | 2-(Furan-2-yl)benzo[d]oxazole
CAS No: 881-60-7 Catalog No: AG004E5Q MDL No:MFCD02189624
Product Description
Catalog Number:
AG004E5Q
Chemical Name:
2-(Furan-2-yl)benzo[d]oxazole
CAS Number:
881-60-7
Molecular Formula:
C11H7NO2
Molecular Weight:
185.1788
MDL Number:
MFCD02189624
IUPAC Name:
2-(furan-2-yl)-1,3-benzoxazole
InChI:
InChI=1S/C11H7NO2/c1-2-5-9-8(4-1)12-11(14-9)10-6-3-7-13-10/h1-7H
InChI Key:
OXQATLMDNGJNBH-UHFFFAOYSA-N
SMILES:
c1coc(c1)c1nc2c(o1)cccc2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.182g/mol
Monoisotopic Mass:
185.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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