CAS
6544-00-9 Purity
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6544-00-9 Purity
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(3,5,5-Trimethyl-1-oxido-4H-pyrazol-3-yl)4-fluorobenzoate
CAS
65441-88-5
Catalog Number
ACM65441885
Category
Other Products
Molecular Weight
266.2682
Molecular Formula
C13H15FN2O3
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Specification
Synonyms
NSC265476, AC1L811R, NSC-265476, (3,5,5-trimethyl-1-oxido-4H-pyrazol-1-ium-3-yl) 4-fluorobenzoate, 65441-88-5
IUPAC Name
(3,5,5-trimethyl-1-oxido-4H-pyrazol-1-ium-3-yl) 4-fluorobenzoate
Canonical SMILES
CC1(CC(N=[N+]1[O-])(C)OC(=O)C2=CC=C(C=C2)F)C
InChI Key
WVXGRVASSFIWFK-UHFFFAOYSA-N
Boiling Point
355.1ºC at 760mmHg
Flash Point
168.6ºC
Density
1.25g/cm³
Exact Mass
266.10700
H-Bond Acceptor
5
H-Bond Donor
0
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