Home Halogens 5-butyl-3-(chloromethyl)-1,2,4-oxadiazole

5-butyl-3-(chloromethyl)-1,2,4-oxadiazole

CAS No.:
1092301-09-1
Catalog Number:
AG019WXL
Molecular Formula:
C7H11ClN2O
Molecular Weight:
174.6280
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Product Description
Catalog Number:
AG019WXL
Chemical Name:
5-butyl-3-(chloromethyl)-1,2,4-oxadiazole
CAS Number:
1092301-09-1
Molecular Formula:
C7H11ClN2O
Molecular Weight:
174.6280
MDL Number:
MFCD10691081
IUPAC Name:
5-butyl-3-(chloromethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C7H11ClN2O/c1-2-3-4-7-9-6(5-8)10-11-7/h2-5H2,1H3
InChI Key:
QMJCZRZSENJKDN-UHFFFAOYSA-N
SMILES:
CCCCc1onc(n1)CCl
Properties
Complexity:
113  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.628g/mol
Monoisotopic Mass:
174.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties