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98664-63-2 | 5-ETHYL-3-PYRIDINECARBOXALDEHYDE
CAS No: 98664-63-2 Catalog No: AG01C7LF MDL No:MFCD18256090
Product Description
Catalog Number:
AG01C7LF
Chemical Name:
5-ETHYL-3-PYRIDINECARBOXALDEHYDE
CAS Number:
98664-63-2
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD18256090
IUPAC Name:
5-ethylpyridine-3-carbaldehyde
InChI:
InChI=1S/C8H9NO/c1-2-7-3-8(6-10)5-9-4-7/h3-6H,2H2,1H3
InChI Key:
BCAZDFGRWQVGFI-UHFFFAOYSA-N
SMILES:
CCc1cncc(c1)C=O
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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