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

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

CAS No.:
74025-73-3
Catalog Number:
AG005A1N
Molecular Formula:
C4H6ClN5O
Molecular Weight:
175.5763
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Product Description
Catalog Number:
AG005A1N
Chemical Name:
Guanidine, [3-(chloromethyl)-1,2,4-oxadiazol-5-yl]-
CAS Number:
74025-73-3
Molecular Formula:
C4H6ClN5O
Molecular Weight:
175.5763
MDL Number:
MFCD20627243
IUPAC Name:
2-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]guanidine
InChI:
InChI=1S/C4H6ClN5O/c5-1-2-8-4(11-10-2)9-3(6)7/h1H2,(H4,6,7,8,9,10)
InChI Key:
IPOXPXHQMSEBFF-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1nc(no1)CCl
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.026g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.576g/mol
Monoisotopic Mass:
175.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties