Home Aldehydes 4-(1,2,4-Oxadiazol-3-yl)benzaldehyde

4-(1,2,4-Oxadiazol-3-yl)benzaldehyde

CAS No.:
545424-41-7
Catalog Number:
AG00DCOL
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG00DCOL
Chemical Name:
4-(1,2,4-Oxadiazol-3-yl)benzaldehyde
CAS Number:
545424-41-7
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD12026816
IUPAC Name:
4-(1,2,4-oxadiazol-3-yl)benzaldehyde
InChI:
InChI=1S/C9H6N2O2/c12-5-7-1-3-8(4-2-7)9-10-6-13-11-9/h1-6H
InChI Key:
KPIGPNUESQGOAO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1nocn1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties