Home Halogens methyl 3-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]propanoate

methyl 3-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]propanoate

CAS No.:
500025-81-0
Catalog Number:
AG01AH9C
Molecular Formula:
C7H9ClN2O3
Molecular Weight:
204.6110
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Product Description
Catalog Number:
AG01AH9C
Chemical Name:
methyl 3-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]propanoate
CAS Number:
500025-81-0
Molecular Formula:
C7H9ClN2O3
Molecular Weight:
204.6110
MDL Number:
MFCD18483251
IUPAC Name:
methyl 3-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]propanoate
InChI:
InChI=1S/C7H9ClN2O3/c1-12-7(11)3-2-6-9-5(4-8)10-13-6/h2-4H2,1H3
InChI Key:
RFLDKZVWVQBDRB-UHFFFAOYSA-N
SMILES:
COC(=O)CCc1nc(no1)CCl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.61g/mol
Monoisotopic Mass:
204.03g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties