BENZYLIDENEMALONONITRILE

CAS No.：2700-22-3

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This product is a chemical product/pharmaceutical intermediate. It is not a drug, an active pharmaceutical ingredient (API), or a pharmaceutical-grade material. It has not been granted a drug approval number or a Chemical Drug Substance Approval Notice, has not passed drug-related review and approval, and is not manufactured, tested, or released in accordance with pharmaceutical GMP.
This product is intended solely for non-clinical research, process development, quality studies, further chemical processing, or chemical synthesis. It must not be used in drug-product manufacturing, clinical trials, clinical diagnosis, or administration to humans or animals, or be sold, used as an input, submitted for regulatory filing, or released as an API or pharmaceutical material.
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BENZYLIDENEMALONONITRILE Basic information

Product Name:	BENZYLIDENEMALONONITRILE
Synonyms:	BENZALMALONONITRILE;BENZYLIDENEMALONONITRILE;benzal-malonitril;benzylidene-malononitril;f2370;RARECHEM AL BX 0531;AKOS USSH-4110217;2-BENZYLIDENE-MALONONITRILE
CAS:	2700-22-3
MF:	C10H6N2
MW:	154.17
EINECS:	220-283-6
Product Categories:	C10 to C27;Cyanides/Nitriles;Nitrogen Compounds;Building Blocks;C10 to C27;Chemical Synthesis;Nitrogen Compounds;Organic Building Blocks
Mol File:	2700-22-3.mol

BENZYLIDENEMALONONITRILE Chemical Properties

Melting point	83-85 °C (lit.)
Boiling point	120-125°C 0,6mm
density	1.1975 (rough estimate)
refractive index	1.4820 (estimate)
Fp	120-125°C/0.6mm
storage temp.	Sealed in dry,Room Temperature
solubility	soluble in Methanol
form	powder to crystal
color	White to Orange to Green
BRN	1907519
CAS DataBase Reference	2700-22-3(CAS DataBase Reference)

Safety Information

Hazard Codes	Xn
Risk Statements	20/21/22-36/37/38
Safety Statements	26-36/37/39
RIDADR	3276
WGK Germany	3
RTECS	OO3500000
HazardClass	6.1
PackingGroup	III
HS Code	29269095

MSDS Information

Provider	Language
ACROS	English
SigmaAldrich	English
ALFA	English

BENZYLIDENEMALONONITRILE Usage And Synthesis

Chemical Properties	SLIGHTLY YELLOW NEEDLE-LIKE CRYSTALLINE POWDER
Uses	Benzylidenemalononitrile was used in fluorescence-based assay for determination of soluble methane monooxygenase activity in solution.
Synthesis Reference(s)	The Journal of Organic Chemistry, 49, p. 4819, 1984 DOI: 10.1021/jo00199a014Tetrahedron Letters, 23, p. 4927, 1982 DOI: 10.1016/S0040-4039(00)85749-4
General Description	Benzylidenemalononitrile undergoes rapid and catalyst-free solid/vapor reaction with primary alkyl amines to yield N-benzylidene-amine. It undergoes addition reaction with octyl- and decylzirconocene chloride. It is a potential substrate for soluble methane monooxygenase.
Purification Methods	Recrystallise the nitrile from EtOH [Bernasconi et al. J Am Chem Soc 107 3612 1985]. It has max at 307nm (EtOH). [Beilstein 9 H 895, 9 II 640, 9 III 4380, 9 IV 3462.]

BENZYLIDENEMALONONITRILE Preparation Products And Raw materials

Raw materials

ZEAUJQWDPKRESH-SDNWHVSQSA-N-->Benzene, (2,2-dinitroethenyl)--->Benzenemethanamine, N-(phenyl-13C)- (9CI)-->2-amino-7-hydroxy-4-phenyl-4H-chromene-3-carbonitrile-->3-amino-1-phenyl-1H-benzo[f]chromene-2-carbonitrile-->14H-Dibenzo[a,j]xanthene, 14-phenyl--->2-PHENYL-1,3-DIOXOLANE-->N-Benzylideneaniline-->Benzaldehyde-->Diethyl phosphite-->Benzoic acid-->2-Naphthol

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