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162960-26-1 | Cyclopropanecarboxylic acid, 1-(2-pyridinyl)-
CAS No: 162960-26-1 Catalog No: AG001TKE MDL No:MFCD09864786
Product Description
Catalog Number:
AG001TKE
Chemical Name:
Cyclopropanecarboxylic acid, 1-(2-pyridinyl)-
CAS Number:
162960-26-1
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD09864786
IUPAC Name:
1-pyridin-2-ylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C9H9NO2/c11-8(12)9(4-5-9)7-3-1-2-6-10-7/h1-3,6H,4-5H2,(H,11,12)
InChI Key:
DHOWKIWZOCQDDV-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1ccccn1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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