Home Halogens 3-(chloromethyl)-1-(4-chlorophenyl)-1H-pyrazole

3-(chloromethyl)-1-(4-chlorophenyl)-1H-pyrazole

CAS No.:
1481659-08-8
Catalog Number:
AG01ACMO
Molecular Formula:
C10H8Cl2N2
Molecular Weight:
227.0899
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Product Description
Catalog Number:
AG01ACMO
Chemical Name:
3-(chloromethyl)-1-(4-chlorophenyl)-1H-pyrazole
CAS Number:
1481659-08-8
Molecular Formula:
C10H8Cl2N2
Molecular Weight:
227.0899
MDL Number:
MFCD21304457
IUPAC Name:
3-(chloromethyl)-1-(4-chlorophenyl)pyrazole
InChI:
InChI=1S/C10H8Cl2N2/c11-7-9-5-6-14(13-9)10-3-1-8(12)2-4-10/h1-6H,7H2
InChI Key:
XSJHLPIPWYOPSS-UHFFFAOYSA-N
SMILES:
ClCc1ccn(n1)c1ccc(cc1)Cl
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.006g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.088g/mol
Monoisotopic Mass:
226.006g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties