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1256785-01-9 | 4-Pyridinecarboxylic acid, 3-cyclopropyl-
CAS No: 1256785-01-9 Catalog No: AG000OCR MDL No:MFCD18261166
Product Description
Catalog Number:
AG000OCR
Chemical Name:
4-Pyridinecarboxylic acid, 3-cyclopropyl-
CAS Number:
1256785-01-9
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD18261166
IUPAC Name:
3-cyclopropylpyridine-4-carboxylic acid
InChI:
InChI=1S/C9H9NO2/c11-9(12)7-3-4-10-5-8(7)6-1-2-6/h3-6H,1-2H2,(H,11,12)
InChI Key:
YFEUTSSBMQWQAD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccncc1C1CC1
Properties
Complexity:
189
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:
1.3
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