Home Other Building Blocks 3-(CHLOROMETHYL)-1-PROPYL-1H-PYRAZOLE

3-(CHLOROMETHYL)-1-PROPYL-1H-PYRAZOLE

CAS No.:
1707359-95-2
Catalog Number:
AG01AOTT
Molecular Formula:
C7H11ClN2
Molecular Weight:
158.6286
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Product Description
Catalog Number:
AG01AOTT
Chemical Name:
3-(CHLOROMETHYL)-1-PROPYL-1H-PYRAZOLE
CAS Number:
1707359-95-2
Molecular Formula:
C7H11ClN2
Molecular Weight:
158.6286
MDL Number:
MFCD26381618
IUPAC Name:
3-(chloromethyl)-1-propylpyrazole
InChI:
InChI=1S/C7H11ClN2/c1-2-4-10-5-3-7(6-8)9-10/h3,5H,2,4,6H2,1H3
InChI Key:
NUWVUPMTMSOMQG-UHFFFAOYSA-N
SMILES:
CCCn1ccc(n1)CCl
Properties
Complexity:
97.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.629g/mol
Monoisotopic Mass:
158.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties