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18859-35-3 | 2-Propanone, 1-(4-chlorophenoxy)-
CAS No: 18859-35-3 Catalog No: AG002H18 MDL No:MFCD06659690
Product Description
Catalog Number:
AG002H18
Chemical Name:
2-Propanone, 1-(4-chlorophenoxy)-
CAS Number:
18859-35-3
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD06659690
IUPAC Name:
1-(4-chlorophenoxy)propan-2-one
InChI:
InChI=1S/C9H9ClO2/c1-7(11)6-12-9-4-2-8(10)3-5-9/h2-5H,6H2,1H3
InChI Key:
DFBZHQBJMFLYJF-UHFFFAOYSA-N
SMILES:
CC(=O)COc1ccc(cc1)Cl
NSC Number:
45653
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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