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1306604-39-6

1306604-39-6 | 2-(2,2,2-trifluoroethoxy)cyclohex-1-ene-1-carbaldehyde

CAS No: 1306604-39-6 Catalog No: AG01AHY0 MDL No:MFCD18838743

Product Description

Catalog Number:
AG01AHY0
Chemical Name:
2-(2,2,2-trifluoroethoxy)cyclohex-1-ene-1-carbaldehyde
CAS Number:
1306604-39-6
Molecular Formula:
C9H11F3O2
Molecular Weight:
208.1776
MDL Number:
MFCD18838743
IUPAC Name:
2-(2,2,2-trifluoroethoxy)cyclohexene-1-carbaldehyde
InChI:
InChI=1S/C9H11F3O2/c10-9(11,12)6-14-8-4-2-1-3-7(8)5-13/h5H,1-4,6H2
InChI Key:
DOQGMUFSYWJSQA-UHFFFAOYSA-N
SMILES:
O=CC1=C(CCCC1)OCC(F)(F)F

Properties

Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.071g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.18g/mol
Monoisotopic Mass:
208.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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