2-Naphthyl trifluoromethanesulfonate - CAS 3857-83-8

Catalog:	BB023707
Product Name:	2-Naphthyl trifluoromethanesulfonate
CAS:	3857-83-8
Synonyms:	naphthalen-2-yl trifluoromethanesulfonate

Technical Data

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Computed Properties

IUPAC Name:	naphthalen-2-yl trifluoromethanesulfonate
Description:	2-Naphthyl trifluoromethanesulfonate (CAS# 3857-83-8) is a useful research chemical.
Molecular Weight:	276.23
Molecular Formula:	C11H7F3O3S
Canonical SMILES:	C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F
InChI:	InChI=1S/C11H7F3O3S/c12-11(13,14)18(15,16)17-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
InChI Key:	MDWRQYBWVTXIIJ-UHFFFAOYSA-N
Boiling Point:	343.8 °C at 760 mmHg
Density:	1.493 g/cm³
Appearance:	White to orange solid
MDL:	MFCD00192341
LogP:	4.14900

Publication Number	Title	Priority Date
WO-2021116686-A1	Methyl 2-allyl-1 -methyl-3-oxoindoline-2-carboxylate and 9a-allyl-1,2,3,9a-tetrahydro-9h-pyrrolo[1,2-a]indol-9-one derivatives and related compounds for use as fluorescent markers for labelling of drugs, amino acids an proteins	20191210
CN-110903316-A	Phosphonate compound and preparation method and application thereof	20191205
CN-110903316-B	Phosphonate compound and preparation method and application thereof	20191205
DE-102019129517-A1	Cationically moisture-induced hardenable mass, use of the mass and methods for joining, potting and coating substrates	20191031
WO-2021083632-A1	Composition curable cationically in a moisture-induced manner, use of the composition and method of joining, encapsulating and coating substrates	20191031

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GHS Hazard Statement:	H314 (97.44%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	385
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	276.00679974
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	276.00679974
Rotatable Bond Count:	2
Topological Polar Surface Area:	51.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2