Ethanimidic acid, 2,2,2-trichloro-, methyl ester


Chemical Name: Ethanimidic acid, 2,2,2-trichloro-, methyl ester
CAS Number: 2533-69-9
Product Number: AG003RL8(AGN-PC-0JLC7P)
Synonyms:
MDL No:
Molecular Formula: C3H4Cl3NO
Molecular Weight: 176.4290

Identification/Properties


Properties
MP:
-30℃
BP:
148.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.478(lit.)
Computed Properties
Molecular Weight:
176.421g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
174.936g/mol
Monoisotopic Mass:
174.936g/mol
Topological Polar Surface Area:
33.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
97.2
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:
H227-H315-H319-H335
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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