Home Halogens 2-(chloromethyl)-5-propyl-1,3,4-thiadiazole

2-(chloromethyl)-5-propyl-1,3,4-thiadiazole

CAS No.:
1423029-15-5
Catalog Number:
AG01A33C
Molecular Formula:
C6H9ClN2S
Molecular Weight:
176.6671
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Product Description
Catalog Number:
AG01A33C
Chemical Name:
2-(chloromethyl)-5-propyl-1,3,4-thiadiazole
CAS Number:
1423029-15-5
Molecular Formula:
C6H9ClN2S
Molecular Weight:
176.6671
MDL Number:
MFCD21288310
IUPAC Name:
2-(chloromethyl)-5-propyl-1,3,4-thiadiazole
InChI:
InChI=1S/C6H9ClN2S/c1-2-3-5-8-9-6(4-7)10-5/h2-4H2,1H3
InChI Key:
IQWUYTLZCVLUJU-UHFFFAOYSA-N
SMILES:
CCCc1nnc(s1)CCl
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.017g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.662g/mol
Monoisotopic Mass:
176.017g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties