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1035559-58-0 | Ethyl 2-(2,2-difluorocyclohexyl) acetate
CAS No: 1035559-58-0 Catalog No: AG01FBRE MDL No:MFCD19442249
Product Description
Catalog Number:
AG01FBRE
Chemical Name:
Ethyl 2-(2,2-difluorocyclohexyl) acetate
CAS Number:
1035559-58-0
Molecular Formula:
C10H16F2O2
Molecular Weight:
206.2296
MDL Number:
MFCD19442249
IUPAC Name:
ethyl 2-(2,2-difluorocyclohexyl)acetate
InChI:
InChI=1S/C10H16F2O2/c1-2-14-9(13)7-8-5-3-4-6-10(8,11)12/h8H,2-7H2,1H3
InChI Key:
METPEYIWWISPRR-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1CCCCC1(F)F
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.233g/mol
Monoisotopic Mass:
206.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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