Home Aldehydes 3-Isoxazolecarboxaldehyde, 5-ethyl-

3-Isoxazolecarboxaldehyde, 5-ethyl-

CAS No.:
1368365-43-8
Catalog Number:
AG0012G1
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0012G1
Chemical Name:
3-Isoxazolecarboxaldehyde, 5-ethyl-
CAS Number:
1368365-43-8
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD16249806
IUPAC Name:
5-ethyl-1,2-oxazole-3-carbaldehyde
InChI:
InChI=1S/C6H7NO2/c1-2-6-3-5(4-8)7-9-6/h3-4H,2H2,1H3
InChI Key:
PEIUQQRFQZZTDD-UHFFFAOYSA-N
SMILES:
CCc1onc(c1)C=O
Properties
Complexity:
105  
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:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties