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Home > Fluorides > 164021-26-5
164021-26-5 | 5-Tetradecyl-6-trifluoromethyl[1,3]oxazine-2,4-dione
CAS No: 164021-26-5 Catalog No: AG01F2KT MDL No:MFCD05864370
Product Description
Catalog Number:
AG01F2KT
Chemical Name:
5-Tetradecyl-6-trifluoromethyl[1,3]oxazine-2,4-dione
CAS Number:
164021-26-5
Molecular Formula:
C19H30F3NO3
Molecular Weight:
377.4416
MDL Number:
MFCD05864370
IUPAC Name:
5-tetradecyl-6-(trifluoromethyl)-1,3-oxazine-2,4-dione
InChI:
InChI=1S/C19H30F3NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(19(20,21)22)26-18(25)23-17(15)24/h2-14H2,1H3,(H,23,24,25)
InChI Key:
ZMWAFQMCTNHBRL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCc1c(=O)[nH]c(=O)oc1C(F)(F)F
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.218g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
377.448g/mol
Monoisotopic Mass:
377.218g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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