Home Other Building Blocks 2-[4-(trifluoromethyl)phenyl]propanal

2-[4-(trifluoromethyl)phenyl]propanal

CAS No.:
103108-04-9
Catalog Number:
AG01B9G0
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
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Product Description
Catalog Number:
AG01B9G0
Chemical Name:
2-[4-(trifluoromethyl)phenyl]propanal
CAS Number:
103108-04-9
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
MDL Number:
MFCD18909075
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]propanal
InChI:
InChI=1S/C10H9F3O/c1-7(6-14)8-2-4-9(5-3-8)10(11,12)13/h2-7H,1H3
InChI Key:
DSSWFPLIMLGSAD-UHFFFAOYSA-N
SMILES:
O=CC(c1ccc(cc1)C(F)(F)F)C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.176g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties