4-Hydroxypyrimidine-5-carbonitrile - CAS 4774-34-9

Catalog:	BB026383
Product Name:	4-Hydroxypyrimidine-5-carbonitrile
CAS:	4774-34-9
Synonyms:	6-oxo-1H-pyrimidine-5-carbonitrile

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	6-oxo-1H-pyrimidine-5-carbonitrile
Description:	4-Hydroxypyrimidine-5-carbonitrile (CAS# 4774-34-9) is a useful research chemical.
Molecular Weight:	121.10
Molecular Formula:	C5H3N3O
Canonical SMILES:	C1=C(C(=O)NC=N1)C#N
InChI:	InChI=1S/C5H3N3O/c6-1-4-2-7-3-8-5(4)9/h2-3H,(H,7,8,9)
InChI Key:	SVOQOFSQLVVHKQ-UHFFFAOYSA-N
Boiling Point:	334.5 °C at 760 mmHg
Purity:	97 %
Density:	1.45 g/cm³
MDL:	MFCD00087111
LogP:	0.05388

Publication Number	Title	Priority Date
CN-106496143-A	The synthetic method of medical raw material 4 hydroxyl 2 methylthiopyrimidine 5 nitriles	20161019
JP-WO2017170859-A1	Bisaryl derivatives and pharmaceutical uses thereof	20160330
JP-WO2017170860-A1	Heat shock protein 47 inhibitor	20160330
WO-2017170859-A1	Bisaryl derivative and pharmaceutical application therefor	20160330
WO-2017170860-A1	Heat shock protein 47 inhibitor	20160330

PMID	Publication Date	Title	Journal
22607683	20120615	5-Cyano-6-oxo-1,6-dihydro-pyrimidines as potent antagonists targeting exchange proteins directly activated by cAMP	Bioorganic & medicinal chemistry letters

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

Other Pyrimidines

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[452-76-6]
2,4-Difluorotoluene
[351-28-0]
3'-Fluoroacetanilide
[13566-71-7]
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[451-46-7]
Ethyl 4-fluorobenzoate

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501
Signal Word:	Danger

Complexity:	242
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	121.027611728
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	121.027611728
Rotatable Bond Count:	0
Topological Polar Surface Area:	65.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8