3-Indoleacetonitrile

ALDRICH/129453 - 98%

Synonym: (3-Indolyl)acetonitrile; 3-(Cyanomethyl)indole; IAN; Indolylacetonitrile; NSC 523272

CAS Number: 771-51-7
Empirical Formula (Hill Notation): C₁₀H₈N₂
Molecular Weight: 156.18
EC Number: 212-232-1
MDL Number: MFCD00005628
Linear Formula: C₁₀H₈N₂
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-129453-5G	5 g	$66.20 1/EAAdd To Favorites	Add To Favorites
45-129453-25G	25 g	$0.00 1/EA CALL FOR PRICEAdd To Favorites	Add To Favorites

assay	98%
bp	157-160 °C/0.2 mmHg (lit.)
form	solid
functional group	nitrile
InChI	1S/C10H8N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5H2
InChI key	DMCPFOBLJMLSNX-UHFFFAOYSA-N
mp	33-36 °C (lit.)
Quality Level	100
SMILES string	N#CCc1c[nH]c2ccccc12

Application:	Reactant for preparation of: • Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators • Histone deacetylase inhibitors • Potential kinase inhibitors • Kv7/KCNQ potassium channel activators • Kinesin-Specific MKLP-2 Inhibitor • Pesticides • Potential PET cancer imaging agents • Agonists of the Farnesoid X Receptor (FXR) as atherosclerosis treatment • Butyrylcholinesterase inhibitors • Necroptosis inhibitors
General description:	3-Indoleacetonitrile (Indolylacetonitrile) is a light-induced auxin-inhibitory substance that is isolated from light-grown cabbage (Brassica olearea L.) shoots. It inhibits the biofilm formation of both E. coli O157:H7 and P. aeruginosa without affecting its growth.
Packaging:	5, 25 g in glass bottle

Hazard Codes	Xn
Risk Statements	20/21/22
Safety Statements	36/37
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	233.6 °F - closed cup
Flash Point(C)	112 °C - closed cup

Purity	98%
bp	157-160 °C/0.2 mmHg (lit.)
mp	33-36 °C (lit.)
UNSPSC	12352100