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Home Carboxys Ethyl 4,4-difluorocyclohexanecarboxylate

Ethyl 4,4-difluorocyclohexanecarboxylate

CAS No.:
178312-47-5
Catalog Number:
AG0025X7
Molecular Formula:
C9H14F2O2
Molecular Weight:
192.2031
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$14
- +
5g
98%
In Stock USA
United States
$42
- +
10g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$182
- +
100g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG0025X7
Chemical Name:
Ethyl 4,4-difluorocyclohexanecarboxylate
CAS Number:
178312-47-5
Molecular Formula:
C9H14F2O2
Molecular Weight:
192.2031
MDL Number:
MFCD03788494
IUPAC Name:
ethyl 4,4-difluorocyclohexane-1-carboxylate
InChI:
InChI=1S/C9H14F2O2/c1-2-13-8(12)7-3-5-9(10,11)6-4-7/h7H,2-6H2,1H3
InChI Key:
HZZDWLBBNSDYQM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC(CC1)(F)F
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.096g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.206g/mol
Monoisotopic Mass:
192.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Aminodifluorosulfinium salts: selective fluorination reagents with enhanced thermal stability and ease of handling. The Journal of organic chemistry 20100521
Properties