Pentafluorophenyl chlorothionoformate - CAS 135192-53-9

Catalog:	BB008091
Product Name:	Pentafluorophenyl chlorothionoformate
CAS:	135192-53-9
Synonyms:	O-(2,3,4,5,6-pentafluorophenyl) chloromethanethioate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	O-(2,3,4,5,6-pentafluorophenyl) chloromethanethioate
Description:	Pentafluorophenyl chlorothionoformate (CAS# 135192-53-9) is a useful research chemical.
Molecular Weight:	262.58
Molecular Formula:	C7ClF5OS
Canonical SMILES:	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=S)Cl
InChI:	InChI=1S/C7ClF5OS/c8-7(15)14-6-4(12)2(10)1(9)3(11)5(6)13
InChI Key:	DKFQHZNKNWNZCO-UHFFFAOYSA-N
Boiling Point:	98-102 ℃50 mmHg (lit.)
Purity:	95 %
Density:	1.635 g/mL at 25℃(lit.)
Appearance:	Solid
Storage:	Inert atmosphere, Room Temperature
MDL:	MFCD00075405
LogP:	3.28460

Publication Number	Title	Priority Date
WO-2020072784-A1	Imaging agents and methods of use	20181005
EP-3860660-A1	Imaging agents and methods of use	20181005
EP-3554548-A1	Noncrushable pill formulatiions	20161219
EP-3555280-A1	Dual-enzyme responsive peptides	20161219
US-2020085964-A1	Noncrushable Pill Formulations	20161219

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Fluorinated Building Blocks

[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[452-76-6]
2,4-Difluorotoluene
[151585-93-2]
2-Amino-6-fluorobenzaldehyde

Other Pyrimidines

[452-76-6]
2,4-Difluorotoluene
[551-62-2]
1,2,3,4-Tetrafluorobenzene
[246847-98-3]
2-Amino-5-chloro-3-fluoropyridine
[932236-53-8]
3-(4-Chlorophenyl)pyrazolo[1,5-a]pyrimidin-6-amine
[672-45-7]
6-(Trifluoromethyl)uracil
[1011349-32-8]
6-Amino-1-isopropyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[85-47-2]
1-Naphthalenesulfonic acid
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[15863-41-9]
4-(Methylthio)phenyl isothiocyanate

GHS Hazard Statement:	H314 (100%): 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:	240
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	261.9278543
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	261.9278543
Rotatable Bond Count:	2
Topological Polar Surface Area:	41.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8