Acetic acid, chlorofluoro-, ethyl ester


Chemical Name: Acetic acid, chlorofluoro-, ethyl ester
CAS Number: 401-56-9
Product Number: AG003QEJ(AGN-PC-0JLCXB)
Synonyms:
MDL No:
Molecular Formula: C4H6ClFO2
Molecular Weight: 140.5406

Identification/Properties


Properties
BP:
133 °C(lit.)
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.396(lit.)
Computed Properties
Molecular Weight:
140.538g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
140.004g/mol
Monoisotopic Mass:
140.004g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
86.1
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
Danger
UN#:
2920
Hazard Statements:
H226-H302+H312+H332-H314
Precautionary Statements:
P233-P241-P242-P264-P270-P271-P280-P304+P340-P305+P351+P338-P310-P330-P331-P363-P370+P378-P403+P235-P501
Class:
8,3
Packing Group:

NMR Spectrum


Other Analytical Data


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