Home Halogens 1-[3-(chloromethyl)phenyl]-1H-pyrazole hydrochloride

1-[3-(chloromethyl)phenyl]-1H-pyrazole hydrochloride

CAS No.:
1432680-29-9
Catalog Number:
AG01A50O
Molecular Formula:
C10H10Cl2N2
Molecular Weight:
229.1058
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Product Description
Catalog Number:
AG01A50O
Chemical Name:
1-[3-(chloromethyl)phenyl]-1H-pyrazole hydrochloride
CAS Number:
1432680-29-9
Molecular Formula:
C10H10Cl2N2
Molecular Weight:
229.1058
MDL Number:
MFCD26959660
IUPAC Name:
1-[3-(chloromethyl)phenyl]pyrazole;hydrochloride
InChI:
InChI=1S/C10H9ClN2.ClH/c11-8-9-3-1-4-10(7-9)13-6-2-5-12-13;/h1-7H,8H2;1H
InChI Key:
MBGVHYKWBVTHFQ-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)n1cccn1.Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.022g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.104g/mol
Monoisotopic Mass:
228.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties