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Home > Aldehydes > 179056-82-7
179056-82-7 | Benzaldehyde, 4-(5-methyl-1,3,4-oxadiazol-2-yl)-
CAS No: 179056-82-7 Catalog No: AG0026QT MDL No:MFCD11109323
Product Description
Catalog Number:
AG0026QT
Chemical Name:
Benzaldehyde, 4-(5-methyl-1,3,4-oxadiazol-2-yl)-
CAS Number:
179056-82-7
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD11109323
IUPAC Name:
4-(5-methyl-1,3,4-oxadiazol-2-yl)benzaldehyde
InChI:
InChI=1S/C10H8N2O2/c1-7-11-12-10(14-7)9-4-2-8(6-13)3-5-9/h2-6H,1H3
InChI Key:
MPECIJQJPPLBGV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1nnc(o1)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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