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23389-75-5 | 4-Pyridinemethanol, α-methyl-
CAS No: 23389-75-5 Catalog No: AG002N29 MDL No:MFCD00077867
Product Description
Catalog Number:
AG002N29
Chemical Name:
4-Pyridinemethanol, α-methyl-
CAS Number:
23389-75-5
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD00077867
IUPAC Name:
1-pyridin-4-ylethanol
InChI:
InChI=1S/C7H9NO/c1-6(9)7-2-4-8-5-3-7/h2-6,9H,1H3
InChI Key:
HVOAMIOKNARIMR-UHFFFAOYSA-N
SMILES:
CC(c1ccncc1)O
EC Number:
245-630-9
Properties
Complexity:
79
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Richness of isomerism in labile octahedral Werner-type cobalt(II) complexes demonstrated by 19F NMR spectroscopy: structure and stability. | Magnetic resonance in chemistry : MRC 20040901 |
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