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96515-79-6 | 5-Chloro-2-fluorobenzaldehyde
CAS No: 96515-79-6 Catalog No: AG003MMD MDL No:MFCD03094518
Product Description
Catalog Number:
AG003MMD
Chemical Name:
5-Chloro-2-fluorobenzaldehyde
CAS Number:
96515-79-6
Molecular Formula:
C7H4ClFO
Molecular Weight:
158.5575
MDL Number:
MFCD03094518
IUPAC Name:
5-chloro-2-fluorobenzaldehyde
InChI:
InChI=1S/C7H4ClFO/c8-6-1-2-7(9)5(3-6)4-10/h1-4H
InChI Key:
WDTUCEMLUHTMCB-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Cl)ccc1F
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.993g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.556g/mol
Monoisotopic Mass:
157.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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