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1096786-34-3

1096786-34-3 | 2-iso-Butoxy-5-fluorobenzaldehyde

CAS No: 1096786-34-3 Catalog No: AG01FEAR MDL No:

Product Description

Catalog Number:
AG01FEAR
Chemical Name:
2-iso-Butoxy-5-fluorobenzaldehyde
CAS Number:
1096786-34-3
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
IUPAC Name:
5-fluoro-2-(2-methylpropoxy)benzaldehyde
InChI:
InChI=1S/C11H13FO2/c1-8(2)7-14-11-4-3-10(12)5-9(11)6-13/h3-6,8H,7H2,1-2H3
InChI Key:
FABCOSNWTBXZOY-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)ccc1OCC(C)C

Properties

Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.221g/mol
Monoisotopic Mass:
196.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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