4-Pentenoic acid, 2,2-difluoro-, ethyl ester


Chemical Name: 4-Pentenoic acid, 2,2-difluoro-, ethyl ester
CAS Number: 110482-96-7
Product Number: AG0037ZT(AGN-PC-000930)
Synonyms:
MDL No: MFCD09763639
Molecular Formula: C7H10F2O2
Molecular Weight: 164.1499

Identification/Properties


Computed Properties
Molecular Weight:
164.152g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
164.065g/mol
Monoisotopic Mass:
164.065g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
155
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-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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