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1159734-52-7 | Cyclopropanecarboxylic acid, 1-(2-pyrazinyl)-
CAS No: 1159734-52-7 Catalog No: AG000H8W MDL No:MFCD17926215
Product Description
Catalog Number:
AG000H8W
Chemical Name:
Cyclopropanecarboxylic acid, 1-(2-pyrazinyl)-
CAS Number:
1159734-52-7
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
MDL Number:
MFCD17926215
IUPAC Name:
1-pyrazin-2-ylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C8H8N2O2/c11-7(12)8(1-2-8)6-5-9-3-4-10-6/h3-5H,1-2H2,(H,11,12)
InChI Key:
SEUCPZSOHHNMRQ-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1nccnc1
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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