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Home > Aldehydes > 290307-39-0
290307-39-0 | Benzaldehyde, 3-(cyclobutyloxy)-4-(difluoromethoxy)-
CAS No: 290307-39-0 Catalog No: AG002V92 MDL No:
Product Description
Catalog Number:
AG002V92
Chemical Name:
Benzaldehyde, 3-(cyclobutyloxy)-4-(difluoromethoxy)-
CAS Number:
290307-39-0
Molecular Formula:
C12H12F2O3
Molecular Weight:
242.2187
IUPAC Name:
3-cyclobutyloxy-4-(difluoromethoxy)benzaldehyde
InChI:
InChI=1S/C12H12F2O3/c13-12(14)17-10-5-4-8(7-15)6-11(10)16-9-2-1-3-9/h4-7,9,12H,1-3H2
InChI Key:
BMFYWBXIAYGBBE-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)OC1CCC1)OC(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.222g/mol
Monoisotopic Mass:
242.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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