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1993265-20-5 | methyl 3-hydroxy-5-(trifluoromethyl)cyclohexane-1-carboxylate
CAS No: 1993265-20-5 Catalog No: AG01FLBA MDL No:
Product Description
Catalog Number:
AG01FLBA
Chemical Name:
methyl 3-hydroxy-5-(trifluoromethyl)cyclohexane-1-carboxylate
CAS Number:
1993265-20-5
IUPAC Name:
methyl 3-hydroxy-5-(trifluoromethyl)cyclohexane-1-carboxylate
InChI:
InChI=1S/C9H13F3O3/c1-15-8(14)5-2-6(9(10,11)12)4-7(13)3-5/h5-7,13H,2-4H2,1H3
InChI Key:
BZRKVXHQNGELJP-UHFFFAOYSA-N
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.082g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.195g/mol
Monoisotopic Mass:
226.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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