5-Cyano-6-methylnicotinic Acid - CAS 1216866-96-4

Catalog:	BB005239
Product Name:	5-Cyano-6-methylnicotinic Acid
CAS:	1216866-96-4
Synonyms:	5-cyano-6-methyl-3-pyridinecarboxylic acid; 5-cyano-6-methylpyridine-3-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-cyano-6-methylpyridine-3-carboxylic acid
Description:	5-Cyano-6-methylnicotinic Acid (CAS# 1216866-96-4) is a useful research chemical.
Molecular Weight:	162.15
Molecular Formula:	C8H6N2O2
Canonical SMILES:	CC1=NC=C(C=C1C#N)C(=O)O
InChI:	InChI=1S/C8H6N2O2/c1-5-6(3-9)2-7(4-10-5)8(11)12/h2,4H,1H3,(H,11,12)
InChI Key:	DIHBEWMXYDGNED-UHFFFAOYSA-N
LogP:	0.95988

Publication Number	Title	Priority Date
CN-109134476-A	Bridged ring piperazine derivative or its salt and its preparation method and application	20170615
CN-109134476-B	Bridged ring piperazine derivative or salt thereof, and preparation method and application thereof	20170615
TW-201714884-A	Novel compounds	20151028
WO-2017004608-A1	Oxadiazole modulators of s1p methods of making and using	20150702
AU-2015267909-A1	Novel compounds	20140528

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

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	231
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.042927438
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	162.042927438
Rotatable Bond Count:	1
Topological Polar Surface Area:	74 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5