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Home > Aldehydes > 944898-37-7
944898-37-7 | 2-[3-(trifluoromethoxy)phenyl]acetaldehyde
CAS No: 944898-37-7 Catalog No: AG01BFZR MDL No:MFCD10696558
Product Description
Catalog Number:
AG01BFZR
Chemical Name:
2-[3-(trifluoromethoxy)phenyl]acetaldehyde
CAS Number:
944898-37-7
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
MDL Number:
MFCD10696558
IUPAC Name:
2-[3-(trifluoromethoxy)phenyl]acetaldehyde
InChI:
InChI=1S/C9H7F3O2/c10-9(11,12)14-8-3-1-2-7(6-8)4-5-13/h1-3,5-6H,4H2
InChI Key:
MVQGPRADDZTDED-UHFFFAOYSA-N
SMILES:
O=CCc1cccc(c1)OC(F)(F)F
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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