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Home > Fluorides > 164228-15-3
164228-15-3 | 4-Pentenoic acid, 2-fluoro-2-propyl-, ethyl ester
CAS No: 164228-15-3 Catalog No: AG001UPX MDL No:
Product Description
Catalog Number:
AG001UPX
Chemical Name:
4-Pentenoic acid, 2-fluoro-2-propyl-, ethyl ester
CAS Number:
164228-15-3
Molecular Formula:
C10H17FO2
Molecular Weight:
188.2392
IUPAC Name:
ethyl 2-fluoro-2-propylpent-4-enoate
InChI:
InChI=1S/C10H17FO2/c1-4-7-10(11,8-5-2)9(12)13-6-3/h4H,1,5-8H2,2-3H3
InChI Key:
MARJODMAYFXORX-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC=C)(CCC)F
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.121g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.242g/mol
Monoisotopic Mass:
188.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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