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Home > Aldehydes > 1381944-68-8
1381944-68-8 | [1,1'-Biphenyl]-4-carboxaldehyde, 3'-chloro-5'-fluoro-
CAS No: 1381944-68-8 Catalog No: AG00187R MDL No:MFCD22375084
Product Description
Catalog Number:
AG00187R
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde, 3'-chloro-5'-fluoro-
CAS Number:
1381944-68-8
Molecular Formula:
C13H8ClFO
Molecular Weight:
234.6534
MDL Number:
MFCD22375084
IUPAC Name:
4-(3-chloro-5-fluorophenyl)benzaldehyde
InChI:
InChI=1S/C13H8ClFO/c14-12-5-11(6-13(15)7-12)10-3-1-9(8-16)2-4-10/h1-8H
InChI Key:
MCIXTJPGYAARQI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1cc(F)cc(c1)Cl
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.654g/mol
Monoisotopic Mass:
234.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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