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Structure

4-Nitrobenzoate trifluoro methanol

CAS
74953-35-8
Catalog Number
ACM74953358
Category
Other Products
Molecular Weight
235.12
Molecular Formula
C8H4F3NO4

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Specification

Synonyms
AG-G-98403, 74953-35-8, CTK5E0743, 4-NITROBENZOATE TRIFLUORO-METHANOL, Methanol,trifluoro-, 4-nitrobenzoate (9CI), Methanol,1,1,1-trifluoro-, 1-(4-nitrobenzoate)
IUPAC Name
4-nitrobenzoic acid;trifluoromethanol
Canonical SMILES
C1=CC(=CC=C1C(=O)OC(F)(F)F)[N+](=O)[O-]
InChI Key
KWVHNDKFELCOIC-UHFFFAOYSA-N
Boiling Point
365.8ºC at 760 mmHg
Flash Point
175ºC
Density
1.511g/cm³
Exact Mass
235.00900
H-Bond Acceptor
8
H-Bond Donor
2
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