Indole-5-carbonitrile - CAS 15861-24-2

Catalog:	BB011439
Product Name:	Indole-5-carbonitrile
CAS:	15861-24-2
Synonyms:	1H-indole-5-carbonitrile

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	1H-indole-5-carbonitrile
Description:	Inhibitor of enzyme.
Molecular Weight:	142.16
Molecular Formula:	C9H6N2
Canonical SMILES:	C1=CC2=C(C=CN2)C=C1C#N
InChI:	InChI=1S/C9H6N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H
InChI Key:	YHYLDEVWYOFIJK-UHFFFAOYSA-N
Purity:	98 %
Density:	1.24 g/cm³
Appearance:	Off-white crystalline powder
MDL:	MFCD00005669
LogP:	2.03958

Publication Number	Title	Priority Date
CN-113368390-A	Preparation of polybenzazole derivative conductive adhesion layer for nerve electrode modification	20210618
CN-113004188-A	Indole derivative, preparation method and application	20210316
CN-112778280-A	Anthraquinone natural product modified derivative	20210108
CN-112574180-A	N-2-pyrimidinyl-3-fluoroindole compound and preparation method and application thereof	20201230
CN-112574180-B	N-2-pyrimidinyl-3-fluoroindole compound and preparation method and application thereof	20201230

PMID	Publication Date	Title	Journal
22729279	20120807	The structure of 5-cyanoindole in the ground and the lowest electronically excited singlet states, deduced from rotationally resolved electronic spectroscopy and ab initio theory	Physical chemistry chemical physics : PCCP
21588725	20100825	4-(1H-Tetra-zol-5-yl)-1H-indole	Acta crystallographica. Section E, Structure reports online
17109534	20061124	Nucleophilic reactivities of indoles	The Journal of organic chemistry
16157507	20060301	1H NMR spectral studies on the polymerization mechanism of indole and its derivatives	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Indoles

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[109021-59-2]
7-Methoxy-1H-indole-3-carbaldehyde
[365547-91-7]
Ethyl 2-amino-5-chloro-1H-indole-3-carboxylate
[467458-46-4]
Ethyl 3-formyl-1H-indole-5-carboxylate
[927181-98-4]
Ethyl 3-formyl-1H-indole-7-carboxylate
[6960-46-9]
Ethyl 7-nitroindole-2-carboxylate

Nitrogen Compounds

[55877-31-1]
1-Benzofuran-3-carbonitrile
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
[7492-88-8]
3-piperidinecarbonitrile
[512809-77-7]
5-[(3,5-Dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
[938001-63-9]
9-Chloro-1-methyl-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-b]quinoline

GHS Hazard Statement:	H302 (20.83%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.053098200
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	142.053098200
Rotatable Bond Count:	0
Topological Polar Surface Area:	39.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4