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14529-53-4 | Pyridine, 2-ethoxy-
CAS No: 14529-53-4 Catalog No: AG001KRM MDL No:MFCD00023464
Product Description
Catalog Number:
AG001KRM
Chemical Name:
Pyridine, 2-ethoxy-
CAS Number:
14529-53-4
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD00023464
IUPAC Name:
2-ethoxypyridine
InChI:
InChI=1S/C7H9NO/c1-2-9-7-5-3-4-6-8-7/h3-6H,2H2,1H3
InChI Key:
LISKAOIANGDBTB-UHFFFAOYSA-N
SMILES:
CCOc1ccccn1
EC Number:
238-553-7
Properties
Complexity:
75.3
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:
0
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Mode of action and quantitative structure-activity correlations of tuberculostatic drugs of the isonicotinic acid hydrazide type. | Journal of medicinal chemistry 19760401 |
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