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380355-65-7 | Ethyl 2-methyl-6-(trifluoromethyl);nicotinate
CAS No: 380355-65-7 Catalog No: AG003Q4S MDL No:MFCD10688283
Product Description
Catalog Number:
AG003Q4S
Chemical Name:
Ethyl 2-methyl-6-(trifluoromethyl);nicotinate
CAS Number:
380355-65-7
Molecular Formula:
C10H10F3NO2
Molecular Weight:
233.1871
MDL Number:
MFCD10688283
IUPAC Name:
ethyl 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C10H10F3NO2/c1-3-16-9(15)7-4-5-8(10(11,12)13)14-6(7)2/h4-5H,3H2,1-2H3
InChI Key:
VWUMOTRXCZMICA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(nc1C)C(F)(F)F
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.19g/mol
Monoisotopic Mass:
233.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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