4-CHLORO-5-METHOXY-1-INDANONE


Chemical Name: 4-CHLORO-5-METHOXY-1-INDANONE
CAS Number: 944109-65-3
Product Number: AG0033ZN(AGN-PC-0WAA9M)
Synonyms:
MDL No:
Molecular Formula: C10H9ClO2
Molecular Weight: 196.6303

Identification/Properties


Properties
MP:
124-128°C
BP:
347.7±42.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
196.63g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
196.029g/mol
Monoisotopic Mass:
196.029g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
217
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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