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18283-03-9 | Pentanoic acid, 2-(ethoxyiminomethyl)-2-fluoro-, ethyl ester
CAS No: 18283-03-9 Catalog No: AG002464 MDL No:
Product Description
Catalog Number:
AG002464
Chemical Name:
Pentanoic acid, 2-(ethoxyiminomethyl)-2-fluoro-, ethyl ester
CAS Number:
18283-03-9
Molecular Formula:
C10H18FNO3
Molecular Weight:
219.2532
IUPAC Name:
ethyl 2-(C-ethoxycarbonimidoyl)-2-fluoropentanoate
InChI:
InChI=1S/C10H18FNO3/c1-4-7-10(11,8(12)14-5-2)9(13)15-6-3/h12H,4-7H2,1-3H3
InChI Key:
PBQJWTWKVNHMCV-UHFFFAOYSA-N
SMILES:
CCON=CC(C(=O)OCC)(CCC)F
NSC Number:
81839
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.127g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.256g/mol
Monoisotopic Mass:
219.127g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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