Ethanol, 2-chloro-, benzoate


Chemical Name: Ethanol, 2-chloro-, benzoate
CAS Number: 939-55-9
Product Number: AG003H28(AGN-PC-0ONRVU)
Synonyms:
MDL No:
Molecular Formula: C9H9ClO2
Molecular Weight: 184.6196

Identification/Properties


Properties
MP:
118°C
BP:
264.8 °C at 760 mmHg
Storage:
Room Temperature;Keep in dry area;
Form:
Solid
Refractive Index:
1.5270-1.5300
Computed Properties
Molecular Weight:
184.619g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
184.029g/mol
Monoisotopic Mass:
184.029g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
142
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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