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Home Other Building Blocks 2-methyl-1,3,4-oxadiazole

2-methyl-1,3,4-oxadiazole

CAS No.:
3451-51-2
Catalog Number:
AG0033DS
Molecular Formula:
C3H4N2O
Molecular Weight:
84.0767
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$94
- +
1g
95%
In Stock USA
United States
$225
- +
5g
96%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG0033DS
Chemical Name:
2-methyl-1,3,4-oxadiazole
CAS Number:
3451-51-2
Molecular Formula:
C3H4N2O
Molecular Weight:
84.0767
MDL Number:
MFCD16877047
IUPAC Name:
2-methyl-1,3,4-oxadiazole
InChI:
InChI=1S/C3H4N2O/c1-3-5-4-2-6-3/h2H,1H3
InChI Key:
ZMSIFDIKIXVLDF-UHFFFAOYSA-N
SMILES:
Cc1nnco1
Properties
Complexity:
48.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
84.032g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
84.078g/mol
Monoisotopic Mass:
84.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Metabolism of 5-isopropyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine (BMS-645737): identification of an unusual N-acetylglucosamine conjugate in the cynomolgus monkey. Drug metabolism and disposition: the biological fate of chemicals 20081201
Properties