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23745-82-6 | Benzeneacetaldehyde,4-hydroxy-, oxime
CAS No: 23745-82-6 Catalog No: AG006V4D MDL No:
Product Description
Catalog Number:
AG006V4D
Chemical Name:
Benzeneacetaldehyde,4-hydroxy-, oxime
CAS Number:
23745-82-6
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
IUPAC Name:
4-[(2E)-2-hydroxyiminoethyl]phenol
InChI:
InChI=1S/C8H9NO2/c10-8-3-1-7(2-4-8)5-6-9-11/h1-4,6,10-11H,5H2/b9-6+
InChI Key:
TVXJJNJGTDWFLD-RMKNXTFCSA-N
SMILES:
ON=CCc1ccc(cc1)O
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Probing crucial metabolic pathways in fungal pathogens of crucifers: biotransformation of indole-3-acetaldoxime, 4-hydroxyphenylacetaldoxime, and their metabolites. | Bioorganic & medicinal chemistry 20030717 |
| Long-distance phloem transport of glucosinolates in Arabidopsis. | Plant physiology 20010901 |
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