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111991-24-3

111991-24-3 | (2-Chloro-6-fluorophenyl)acetaldehyde

CAS No: 111991-24-3 Catalog No: AG01EQRD MDL No:

Product Description

Catalog Number:
AG01EQRD
Chemical Name:
(2-Chloro-6-fluorophenyl)acetaldehyde
CAS Number:
111991-24-3
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
IUPAC Name:
2-(2-chloro-6-fluorophenyl)acetaldehyde
InChI:
InChI=1S/C8H6ClFO/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,5H,4H2
InChI Key:
SDIGRRKTFDIMAY-UHFFFAOYSA-N
SMILES:
O=CCc1c(F)cccc1Cl

Properties

Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.583g/mol
Monoisotopic Mass:
172.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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