Home Other Building Blocks 1-methyl-3-(propan-2-yl)-1H-pyrazole hydrochloride

1-methyl-3-(propan-2-yl)-1H-pyrazole hydrochloride

CAS No.:
2137829-09-3
Catalog Number:
AG01EIAZ
Molecular Formula:
C7H13ClN2
Molecular Weight:
160.6445
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Product Description
Catalog Number:
AG01EIAZ
Chemical Name:
1-methyl-3-(propan-2-yl)-1H-pyrazole hydrochloride
CAS Number:
2137829-09-3
Molecular Formula:
C7H13ClN2
Molecular Weight:
160.6445
MDL Number:
MFCD31456774
IUPAC Name:
1-methyl-3-propan-2-ylpyrazole;hydrochloride
InChI:
InChI=1S/C7H12N2.ClH/c1-6(2)7-4-5-9(3)8-7;/h4-6H,1-3H3;1H
InChI Key:
XQJOAISLZMKGCH-UHFFFAOYSA-N
SMILES:
Cn1ccc(n1)C(C)C.Cl
Properties
Complexity:
90.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.077g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.645g/mol
Monoisotopic Mass:
160.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties