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2-Methyleneglutaronitrile - ≥98.0%(GC), high purity , CAS No.1572-52-7

COA

Grade & Purity:

≥98%(GC)

Cas Number: 1572-52-7
Molecular Weight: 106.13
MDL number: MFCD00001869
PubChem CID: 74080
PubChem SID: 488184864

In stock

Item Number

M132491

Grouped product items
SKU	Size	Availability	Price
M132491-10ml	10ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
M132491-25ml	25ml	8	$14.90
M132491-100ml	100ml	2	$51.90
M132491-500ml	500ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$231.90

Basic Description

Synonyms	AKOS000121394 \| MFCD00001869 \| E77167 \| FT-0633674 \| .ALPHA.-CYANOETHYLACRYLONITRILE \| DTXSID2027418 \| M0222 \| NCGC00248848-01 \| 2-methylidenepentanedinitrile \| 2-Methyleneglutaronitrile \| EINECS 216-391-8 \| DTXCID007418 \| InChI=1/C6H6N2/c1-6(5-8)3-2-4-7/
Specifications & Purity	≥98%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Organic cyanides

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Organic cyanides
Intermediate Tree Nodes	Not available
Direct Parent	Nitriles
Alternative Parents	Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488184864
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184864
IUPAC Name	2-methylidenepentanedinitrile
INCHI	InChI=1S/C6H6N2/c1-6(5-8)3-2-4-7/h1-3H2
InChIKey	NGCJVMZXRCLPRQ-UHFFFAOYSA-N
Smiles	C=C(CCC#N)C#N
Isomeric SMILES	C=C(CCC#N)C#N
Molecular Weight	106.13
Reaxy-Rn	1902959
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1902959&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
C2010152	Certificate of Analysis	Jul 09, 2025	M132491
E1616016	Certificate of Analysis	Jul 09, 2025	M132491
D2319933	Certificate of Analysis	Jan 21, 2022	M132491

Chemical and Physical Properties

Flash Point(°F)	126°C(lit.)
Flash Point(°C)	126°C(lit.)
Boil Point(°C)	98°C
Molecular Weight	106.130 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	106.053 Da
Monoisotopic Mass	106.053 Da
Topological Polar Surface Area	47.600 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	173.000
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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