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140914-89-2 | 2-(Pyrazin-2-yl)acetic acid
CAS No: 140914-89-2 Catalog No: AG001CZU MDL No:MFCD06796638
Product Description
Catalog Number:
AG001CZU
Chemical Name:
2-(Pyrazin-2-yl)acetic acid
CAS Number:
140914-89-2
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD06796638
IUPAC Name:
2-pyrazin-2-ylacetic acid
InChI:
InChI=1S/C6H6N2O2/c9-6(10)3-5-4-7-1-2-8-5/h1-2,4H,3H2,(H,9,10)
InChI Key:
PSDADIDIQCPEQC-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cnccn1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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