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Home > Aldehydes > 852180-60-0
852180-60-0 | 4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzaldehyde
CAS No: 852180-60-0 Catalog No: AG004QAS MDL No:MFCD07772818
Product Description
Catalog Number:
AG004QAS
Chemical Name:
4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzaldehyde
CAS Number:
852180-60-0
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD07772818
IUPAC Name:
4-(5-methyl-1,2,4-oxadiazol-3-yl)benzaldehyde
InChI:
InChI=1S/C10H8N2O2/c1-7-11-10(12-14-7)9-4-2-8(6-13)3-5-9/h2-6H,1H3
InChI Key:
BJICSBRPQDVEHP-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1noc(n1)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:
1.8
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