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23100-12-1 | 3-Pyridinecarboxaldehyde, 6-chloro-
CAS No: 23100-12-1 Catalog No: AG002M72 MDL No:MFCD03095223
Product Description
Catalog Number:
AG002M72
Chemical Name:
3-Pyridinecarboxaldehyde, 6-chloro-
CAS Number:
23100-12-1
Molecular Formula:
C6H4ClNO
Molecular Weight:
141.5551
MDL Number:
MFCD03095223
IUPAC Name:
6-chloropyridine-3-carbaldehyde
InChI:
InChI=1S/C6H4ClNO/c7-6-2-1-5(4-9)3-8-6/h1-4H
InChI Key:
AFWWKZCPPRPDQK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nc1)Cl
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.998g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.554g/mol
Monoisotopic Mass:
140.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Neonicotinoid insecticides: oxidative stress in planta and metallo-oxidase inhibition. | Journal of agricultural and food chemistry 20110511 |
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