Home Other Building Blocks methyl 2-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]acetate

methyl 2-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]acetate

CAS No.:
1798713-42-4
Catalog Number:
AG01BDWD
Molecular Formula:
C6H6F2N2O3
Molecular Weight:
192.1202
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Product Description
Catalog Number:
AG01BDWD
Chemical Name:
methyl 2-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]acetate
CAS Number:
1798713-42-4
Molecular Formula:
C6H6F2N2O3
Molecular Weight:
192.1202
MDL Number:
MFCD28118274
IUPAC Name:
methyl 2-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]acetate
InChI:
InChI=1S/C6H6F2N2O3/c1-12-4(11)2-3-9-10-6(13-3)5(7)8/h5H,2H2,1H3
InChI Key:
SJJNMJZRVQCDJF-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1nnc(o1)C(F)F
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.122g/mol
Monoisotopic Mass:
192.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties