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Home > Aldehydes > 1342457-35-5
1342457-35-5 | 3-(BUTAN-2-YL)-1,2,4-OXADIAZOLE-5-CARBALDEHYDE
CAS No: 1342457-35-5 Catalog No: AG01C9OG MDL No:MFCD18878675
Product Description
Catalog Number:
AG01C9OG
Chemical Name:
3-(BUTAN-2-YL)-1,2,4-OXADIAZOLE-5-CARBALDEHYDE
CAS Number:
1342457-35-5
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD18878675
IUPAC Name:
3-butan-2-yl-1,2,4-oxadiazole-5-carbaldehyde
InChI:
InChI=1S/C7H10N2O2/c1-3-5(2)7-8-6(4-10)11-9-7/h4-5H,3H2,1-2H3
InChI Key:
WXLVSQIKRGURHY-UHFFFAOYSA-N
SMILES:
CCC(c1noc(n1)C=O)C
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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