Home Aldehydes 3-Phenylisoxazole-5-carbaldehyde

3-Phenylisoxazole-5-carbaldehyde

CAS No.:
72418-40-7
Catalog Number:
AG003JVQ
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$80
- +
1g
95%
In Stock USA
United States
$163
- +
5g
95%
In Stock USA
United States
$588
- +
Product Description
Catalog Number:
AG003JVQ
Chemical Name:
3-Phenylisoxazole-5-carbaldehyde
CAS Number:
72418-40-7
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD09817543
IUPAC Name:
3-phenyl-1,2-oxazole-5-carbaldehyde
InChI:
InChI=1S/C10H7NO2/c12-7-9-6-10(11-13-9)8-4-2-1-3-5-8/h1-7H
InChI Key:
SZXMDUKWIYIKKS-UHFFFAOYSA-N
SMILES:
O=Cc1onc(c1)c1ccccc1
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties