Ethyl 4-Fluoro-3-nitrobenzoate - CAS 367-80-6

Catalog:	BB023072
Product Name:	Ethyl 4-Fluoro-3-nitrobenzoate
CAS:	367-80-6
Synonyms:	4-fluoro-3-nitrobenzoic acid ethyl ester; ethyl 4-fluoro-3-nitrobenzoate

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	ethyl 4-fluoro-3-nitrobenzoate
Description:	Ethyl 4-Fluoro-3-nitrobenzoate (CAS# 367-80-6) is a useful research chemical.
Molecular Weight:	213.16
Molecular Formula:	C9H8FNO4
Canonical SMILES:	CCOC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]
InChI:	InChI=1S/C9H8FNO4/c1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h3-5H,2H2,1H3
InChI Key:	YONVBKVUSUGBQR-UHFFFAOYSA-N
Boiling Point:	312.3 °C at 760 mmHg
Density:	1.333 g/cm³
MDL:	MFCD03428515
LogP:	2.43380

Publication Number	Title	Priority Date
WO-2018042342-A1	1,2,3-benzotriazole derivatives as ror gamma t modulators	20160830
AU-2017209935-A1	New substituted cyanoindoline derivatives as NIK inhibitors	20160122
CA-3011880-A1	New substituted cyanoindoline derivatives as nik inhibitors	20160122
EP-3405196-A1	New substituted cyanoindoline derivatives as nik inhibitors	20160122
EP-3405196-B1	New substituted cyanoindoline derivatives as nik inhibitors	20160122

PMID	Publication Date	Title	Journal
21580671	20100317	Ethyl 4-(2-hydroxy-ethyl-amino)-3-nitro-benzoate	Acta crystallographica. Section E, Structure reports online
21577493	20090808	Ethyl 4-butyl-amino-3-nitro-benzoate	Acta crystallographica. Section E, Structure reports online
21582214	20090221	Ethyl 4-fluoro-3-nitro-benzoate	Acta crystallographica. Section E, Structure reports online
21203212	20080716	Ethyl 3-nitro-4-(propyl-amino)benzoate	Acta crystallographica. Section E, Structure reports online

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

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[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
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride

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:	253
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.04373590
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	213.04373590
Rotatable Bond Count:	3
Topological Polar Surface Area:	72.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1