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Home > Aldehydes > 1289148-72-6
1289148-72-6 | 4,5-dimethylnicotinaldehyde
CAS No: 1289148-72-6 Catalog No: AG009JD5 MDL No:MFCD22397759
Product Description
Catalog Number:
AG009JD5
Chemical Name:
4,5-dimethylnicotinaldehyde
CAS Number:
1289148-72-6
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD22397759
IUPAC Name:
4,5-dimethylpyridine-3-carbaldehyde
InChI:
InChI=1S/C8H9NO/c1-6-3-9-4-8(5-10)7(6)2/h3-5H,1-2H3
InChI Key:
MJBFMYYXHFASPM-UHFFFAOYSA-N
SMILES:
O=Cc1cncc(c1C)C
Properties
Complexity:
124
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:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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