Home Halogens 1-(5-chloropentyl)-4-methyl-1H-pyrazole hydrochloride

1-(5-chloropentyl)-4-methyl-1H-pyrazole hydrochloride

CAS No.:
1258649-84-1
Catalog Number:
AG01AAI6
Molecular Formula:
C9H16Cl2N2
Molecular Weight:
223.1427
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Product Description
Catalog Number:
AG01AAI6
Chemical Name:
1-(5-chloropentyl)-4-methyl-1H-pyrazole hydrochloride
CAS Number:
1258649-84-1
Molecular Formula:
C9H16Cl2N2
Molecular Weight:
223.1427
MDL Number:
MFCD17167192
IUPAC Name:
1-(5-chloropentyl)-4-methylpyrazole;hydrochloride
InChI:
InChI=1S/C9H15ClN2.ClH/c1-9-7-11-12(8-9)6-4-2-3-5-10;/h7-8H,2-6H2,1H3;1H
InChI Key:
BGLBTADGZNLOFI-UHFFFAOYSA-N
SMILES:
ClCCCCCn1ncc(c1)C.Cl
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.141g/mol
Monoisotopic Mass:
222.069g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties