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2-(3-Fluoro-2-nitrophenyl)acetonitrile - 95%, high purity , CAS No.105003-88-1

COA

Grade & Purity:

≥95%

Cas Number: 105003-88-1
Molecular Weight: 180.14
PubChem CID: 13581387

In stock

Item Number

F189503

Grouped product items
SKU	Size	Availability	Price	Qty
F189503-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
F189503-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$37.90

Basic Description

Synonyms	2-(3-Fluoro-2-nitrophenyl)acetonitrile \| 105003-88-1 \| MFCD13194393 \| SCHEMBL10958461 \| DTXSID20544294 \| 3-Fluoro-2-nitrophenylacetonitrile \| (3-Fluoro-2-nitrophenyl)acetonitrile \| AKOS016000876 \| DS-5910 \| SY114321 \| CS-0157229 \| A896088
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Names and Identifiers

IUPAC Name	2-(3-fluoro-2-nitrophenyl)acetonitrile
INCHI	InChI=1S/C8H5FN2O2/c9-7-3-1-2-6(4-5-10)8(7)11(12)13/h1-3H,4H2
InChIKey	LWLBXNKHOMUBAF-UHFFFAOYSA-N
Smiles	C1=CC(=C(C(=C1)F)[N+](=O)[O-])CC#N
Isomeric SMILES	C1=CC(=C(C(=C1)F)[N+](=O)[O-])CC#N
Molecular Weight	180.14
Reaxy-Rn	5937338
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5937338&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	180.140 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	180.034 Da
Monoisotopic Mass	180.034 Da
Topological Polar Surface Area	69.600 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	242.000
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

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