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Home Other Building Blocks [1-(prop-2-yn-1-yl)-1H-pyrazol-4-yl]methanamine dihydrochloride

[1-(prop-2-yn-1-yl)-1H-pyrazol-4-yl]methanamine dihydrochloride

CAS No.:
1795278-41-9
Catalog Number:
AG01BEUD
Molecular Formula:
C7H11Cl2N3
Molecular Weight:
208.0883
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Product Description
Catalog Number:
AG01BEUD
Chemical Name:
[1-(prop-2-yn-1-yl)-1H-pyrazol-4-yl]methanamine dihydrochloride
CAS Number:
1795278-41-9
Molecular Formula:
C7H11Cl2N3
Molecular Weight:
208.0883
MDL Number:
MFCD28118438
IUPAC Name:
(1-prop-2-ynylpyrazol-4-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C7H9N3.2ClH/c1-2-3-10-6-7(4-8)5-9-10;;/h1,5-6H,3-4,8H2;2*1H
InChI Key:
PEFHTQDTDMCGKX-UHFFFAOYSA-N
SMILES:
NCc1cnn(c1)CC#C.Cl.Cl
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
208.086g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties