Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate - 97%, high purity , CAS No.1188911-72-9

In stock

Item Number

M586532

Grouped product items
SKU	Size	Availability	Price
M586532-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$28.90
M586532-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$74.90
M586532-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$97.90

Basic Description

Synonyms	Methyl3,3,3-trifluoro-2,2-dimethylpropanoate \| SY105056 \| CS-0043781 \| DS-14782 \| 1188911-72-9 \| AMY3059 \| AKOS005259266 \| STL556237 \| MFCD18253569 \| 3,3,3-Trifluoro-2,2-dimethylpropionic acid methyl ester \| Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate \|
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Desiccated
Shipped In	Wet ice

Names and Identifiers

IUPAC Name	methyl 3,3,3-trifluoro-2,2-dimethylpropanoate
INCHI	InChI=1S/C6H9F3O2/c1-5(2,4(10)11-3)6(7,8)9/h1-3H3
InChi Key	ZVXAFVCHEIPHDR-UHFFFAOYSA-N
Canonical SMILES	CC(C)(C(=O)OC)C(F)(F)F
Isomeric SMILES	CC(C)(C(=O)OC)C(F)(F)F
Molecular Weight	170.13
Reaxy-Rn	22315445
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22315445&ln=

Chemical and Physical Properties

Molecular Weight	170.130 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	170.055 Da
Monoisotopic Mass	170.055 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Reaxy-Rn

22315445

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22315445&ln=

Purity(GC)

97-100（%）

NMR Spectrum 1H

Conforms to structure

GC-MS for identification

Conforms

Solution Calculators

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Basic Description