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96258-62-7 | 3-(fluoromethyl)benzaldehyde
CAS No: 96258-62-7 Catalog No: AG01BKA0 MDL No:MFCD24681309
Product Description
Catalog Number:
AG01BKA0
Chemical Name:
3-(fluoromethyl)benzaldehyde
CAS Number:
96258-62-7
Molecular Formula:
C8H7FO
Molecular Weight:
138.1390
MDL Number:
MFCD24681309
IUPAC Name:
3-(fluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H7FO/c9-5-7-2-1-3-8(4-7)6-10/h1-4,6H,5H2
InChI Key:
VLUXDTNIKMUDNZ-UHFFFAOYSA-N
SMILES:
FCc1cccc(c1)C=O
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.141g/mol
Monoisotopic Mass:
138.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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