Home Other Building Blocks 3,5-dimethyl-1-(prop-2-yn-1-yl)-1H-pyrazole

3,5-dimethyl-1-(prop-2-yn-1-yl)-1H-pyrazole

CAS No.:
27258-02-2
Catalog Number:
AG01AGTN
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
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Product Description
Catalog Number:
AG01AGTN
Chemical Name:
3,5-dimethyl-1-(prop-2-yn-1-yl)-1H-pyrazole
CAS Number:
27258-02-2
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
MDL Number:
MFCD00992040
IUPAC Name:
3,5-dimethyl-1-prop-2-ynylpyrazole
InChI:
InChI=1S/C8H10N2/c1-4-5-10-8(3)6-7(2)9-10/h1,6H,5H2,2-3H3
InChI Key:
IOGBTEWONLZEOO-UHFFFAOYSA-N
SMILES:
Cc1cc(nn1CC#C)C
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.182g/mol
Monoisotopic Mass:
134.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties