Home Other Building Blocks lithium(1+) ion 3-(1-methyl-1H-pyrazol-3-yl)prop-2-ynoate

lithium(1+) ion 3-(1-methyl-1H-pyrazol-3-yl)prop-2-ynoate

CAS No.:
2044835-02-9
Catalog Number:
AG01BVHV
Molecular Formula:
C7H5LiN2O2
Molecular Weight:
156.0678
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Product Description
Catalog Number:
AG01BVHV
Chemical Name:
lithium(1+) ion 3-(1-methyl-1H-pyrazol-3-yl)prop-2-ynoate
CAS Number:
2044835-02-9
Molecular Formula:
C7H5LiN2O2
Molecular Weight:
156.0678
MDL Number:
MFCD30476419
IUPAC Name:
lithium;3-(1-methylpyrazol-3-yl)prop-2-ynoate
InChI:
InChI=1S/C7H6N2O2.Li/c1-9-5-4-6(8-9)2-3-7(10)11;/h4-5H,1H3,(H,10,11);/q;+1/p-1
InChI Key:
NFTCJNZROXWAGW-UHFFFAOYSA-M
SMILES:
[O-]C(=O)C#Cc1ccn(n1)C.[Li+]
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.069g/mol
Monoisotopic Mass:
156.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties