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89114-42-1

89114-42-1 | 2-Furancarboxaldehyde, 5-(1-hydroxyhexyl)-, oxime, (Z)-

CAS No: 89114-42-1 Catalog No: AG003Z01 MDL No:

Product Description

Catalog Number:
AG003Z01
Chemical Name:
2-Furancarboxaldehyde, 5-(1-hydroxyhexyl)-, oxime, (Z)-
CAS Number:
89114-42-1
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
IUPAC Name:
1-[5-(hydroxyiminomethyl)furan-2-yl]hexan-1-ol
InChI:
InChI=1S/C11H17NO3/c1-2-3-4-5-10(13)11-7-6-9(15-11)8-12-14/h6-8,10,13-14H,2-5H2,1H3
InChI Key:
AYTVSPZRMSVQDC-UHFFFAOYSA-N
SMILES:
CCCCCC(c1ccc(o1)/C=N\O)O

Properties

Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.6  

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