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Home > Aldehydes > 1205638-74-9
1205638-74-9 | Benzeneacetaldehyde, 4-fluoro-alpha,alpha-dimethyl-
CAS No: 1205638-74-9 Catalog No: AG01F8OX MDL No:
Product Description
Catalog Number:
AG01F8OX
Chemical Name:
Benzeneacetaldehyde, 4-fluoro-alpha,alpha-dimethyl-
CAS Number:
1205638-74-9
Molecular Formula:
C10H11FO
Molecular Weight:
166.1921
IUPAC Name:
2-(4-fluorophenyl)-2-methylpropanal
InChI:
InChI=1S/C10H11FO/c1-10(2,7-12)8-3-5-9(11)6-4-8/h3-7H,1-2H3
InChI Key:
JQVFVJIMDSFBOR-UHFFFAOYSA-N
SMILES:
O=CC(c1ccc(cc1)F)(C)C
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.195g/mol
Monoisotopic Mass:
166.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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