Name: Name:Benzene-1,2,3,4,5-d5, 6-fluoro-
Brand: Angene
SKU: AG001I4T
Rating: 90 (10 reviews)

Benzene-1,2,3,4,5-d5, 6-fluoro-

CAS No.:

1423-10-5

Catalog Number:

AG001I4T

Molecular Formula:

C6D5F

Molecular Weight:

101.1331

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Purity

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Product Description

Catalog Number:

AG001I4T

Chemical Name:

Benzene-1,2,3,4,5-d5, 6-fluoro-

CAS Number:

1423-10-5

Molecular Formula:

C6D5F

Molecular Weight:

101.1331

MDL Number:

MFCD00000281

IUPAC Name:

1,2,3,4,5-pentadeuterio-6-fluorobenzene

InChI:

InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H/i1D,2D,3D,4D,5D

InChI Key:

PYLWMHQQBFSUBP-RALIUCGRSA-N

SMILES:

c1([2H])c(F)c([2H])c(c(c1[2H])[2H])[2H]

EC Number:

215-831-6

Properties

Complexity:

46.1

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

101.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

101.135g/mol

Monoisotopic Mass:

101.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Solid-state NMR and computational studies of tetratolyl urea calix[4]arene inclusion compounds.	Physical chemistry chemical physics : PCCP 20091028
Accelerated arene ligand exchange in the (Arene)Cr(CO)2L series.	Journal of the American Chemical Society 20050601