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89114-43-2 | 2-Furancarboxaldehyde, 5-(hydroxyphenylmethyl)-, oxime, (Z)-
CAS No: 89114-43-2 Catalog No: AG003ZIU MDL No:
Product Description
Catalog Number:
AG003ZIU
Chemical Name:
2-Furancarboxaldehyde, 5-(hydroxyphenylmethyl)-, oxime, (Z)-
CAS Number:
89114-43-2
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
[5-(hydroxyiminomethyl)furan-2-yl]-phenylmethanol
InChI:
InChI=1S/C12H11NO3/c14-12(9-4-2-1-3-5-9)11-7-6-10(16-11)8-13-15/h1-8,12,14-15H
InChI Key:
BMCYNERZVVFLQH-UHFFFAOYSA-N
SMILES:
O/N=C\c1ccc(o1)C(c1ccccc1)O
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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