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2044713-66-6 | sodium 2-(pyrazin-2-yl)propanoate
CAS No: 2044713-66-6 Catalog No: AG01BXM5 MDL No:MFCD30487870
Product Description
Catalog Number:
AG01BXM5
Chemical Name:
sodium 2-(pyrazin-2-yl)propanoate
CAS Number:
2044713-66-6
Molecular Formula:
C7H7N2NaO2
Molecular Weight:
174.1324
MDL Number:
MFCD30487870
IUPAC Name:
sodium;2-pyrazin-2-ylpropanoate
InChI:
InChI=1S/C7H8N2O2.Na/c1-5(7(10)11)6-4-8-2-3-9-6;/h2-5H,1H3,(H,10,11);/q;+1/p-1
InChI Key:
URDYATHKUIYYQD-UHFFFAOYSA-M
SMILES:
[O-]C(=O)C(c1cnccn1)C.[Na+]
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.135g/mol
Monoisotopic Mass:
174.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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