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Home Aldehydes 3-phenyl-1,2,4-oxadiazole-5-carbaldehyde dihydrate

3-phenyl-1,2,4-oxadiazole-5-carbaldehyde dihydrate

CAS No.:
1559062-07-5
Catalog Number:
AG00J307
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$448
- +
5g
95%
In Stock USA
United States
$1462
- +
Product Description
Catalog Number:
AG00J307
Chemical Name:
3-phenyl-1,2,4-oxadiazole-5-carbaldehyde dihydrate
CAS Number:
1559062-07-5
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
MDL Number:
MFCD13193937
IUPAC Name:
3-phenyl-1,2,4-oxadiazole-5-carbaldehyde;dihydrate
InChI:
InChI=1S/C9H6N2O2.2H2O/c12-6-8-10-9(11-13-8)7-4-2-1-3-5-7;;/h1-6H;2*1H2
InChI Key:
PVROCFZDFSQXHC-UHFFFAOYSA-N
SMILES:
O=Cc1onc(n1)c1ccccc1.O.O
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.189g/mol
Monoisotopic Mass:
210.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties