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452333-58-3 | ethyl 4-fluorocyclohex-3-ene-1-carboxylate
CAS No: 452333-58-3 Catalog No: AG01FLB5 MDL No:
Product Description
Catalog Number:
AG01FLB5
Chemical Name:
ethyl 4-fluorocyclohex-3-ene-1-carboxylate
CAS Number:
452333-58-3
IUPAC Name:
ethyl 4-fluorocyclohex-3-ene-1-carboxylate
InChI:
InChI=1S/C9H13FO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h5,7H,2-4,6H2,1H3
InChI Key:
KBDWYRGBBWDLTP-UHFFFAOYSA-N
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.199g/mol
Monoisotopic Mass:
172.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Aminodifluorosulfinium salts: selective fluorination reagents with enhanced thermal stability and ease of handling. | The Journal of organic chemistry 20100521 |
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