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89114-41-0 | 2-Furancarboxaldehyde, 5-(1-hydroxypropyl)-, oxime, (Z)-
CAS No: 89114-41-0 Catalog No: AG003ZIV MDL No:
Product Description
Catalog Number:
AG003ZIV
Chemical Name:
2-Furancarboxaldehyde, 5-(1-hydroxypropyl)-, oxime, (Z)-
CAS Number:
89114-41-0
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
IUPAC Name:
1-[5-(hydroxyiminomethyl)furan-2-yl]propan-1-ol
InChI:
InChI=1S/C8H11NO3/c1-2-7(10)8-4-3-6(12-8)5-9-11/h3-5,7,10-11H,2H2,1H3
InChI Key:
UINZBKMLMHMBFA-UHFFFAOYSA-N
SMILES:
O/N=C\c1ccc(o1)C(CC)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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