Home Aldehydes 4,5-dimethyl-1,3-oxazole-2-carbaldehyde

4,5-dimethyl-1,3-oxazole-2-carbaldehyde

CAS No.:
65128-98-5
Catalog Number:
AG019ZMA
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
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Product Description
Catalog Number:
AG019ZMA
Chemical Name:
4,5-dimethyl-1,3-oxazole-2-carbaldehyde
CAS Number:
65128-98-5
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD16989182
IUPAC Name:
4,5-dimethyl-1,3-oxazole-2-carbaldehyde
InChI:
InChI=1S/C6H7NO2/c1-4-5(2)9-6(3-8)7-4/h3H,1-2H3
InChI Key:
XHEMOUHXSVJUJF-UHFFFAOYSA-N
SMILES:
O=Cc1oc(c(n1)C)C
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.048g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.127g/mol
Monoisotopic Mass:
125.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties