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1368387-18-1 | 2-(3-Methylpyrazin-2-yl)acetic acid
CAS No: 1368387-18-1 Catalog No: AG01D932 MDL No:
Product Description
Catalog Number:
AG01D932
Chemical Name:
2-(3-Methylpyrazin-2-yl)acetic acid
CAS Number:
1368387-18-1
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
IUPAC Name:
2-(3-methylpyrazin-2-yl)acetic acid
InChI:
InChI=1S/C7H8N2O2/c1-5-6(4-7(10)11)9-3-2-8-5/h2-3H,4H2,1H3,(H,10,11)
InChI Key:
OMFAMJXCWWRNLB-UHFFFAOYSA-N
SMILES:
Cc1nccnc1CC(=O)O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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