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4-Bromo-5-ethoxy-2-nitro-N-propylaniline - 97%, high purity , CAS No.1280786-62-0

COA

Grade & Purity:

≥97%

Cas Number: 1280786-62-0
Molecular Weight: 303.2
PubChem CID: 53216250

In stock

Item Number

B180987

Grouped product items
SKU	Size	Availability	Price
B180987-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$131.90
B180987-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$447.90
B180987-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,470.90

Discover 4-Bromo-5-ethoxy-2-nitro-N-propylaniline by Aladdin Scientific in 97% for only $131.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-BROMO-5-ETHOXY-2-NITRO-N-PROPYLANILINE \| 1280786-62-0 \| DTXSID10681506 \| MFCD18783107 \| AKOS015908035 \| SB82660 \| BS-20600 \| CS-0212003 \| A889086 \| Benzenamine, 4-bromo-5-ethoxy-2-nitro-N-propyl-
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Nitrobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrophenyl ethers
Alternative Parents	Aminophenyl ethers Phenylalkylamines Phenoxy compounds Aniline and substituted anilines Nitroaromatic compounds Secondary alkylarylamines Alkyl aryl ethers Bromobenzenes Aryl bromides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic salts Organic zwitterions Organobromides Organopnictogen compounds Organic oxides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrophenyl ether - Aminophenyl ether - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Ether - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organooxygen compound - Organohalogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	4-bromo-5-ethoxy-2-nitro-N-propylaniline
INCHI	InChI=1S/C11H15BrN2O3/c1-3-5-13-9-7-11(17-4-2)8(12)6-10(9)14(15)16/h6-7,13H,3-5H2,1-2H3
InChIKey	AISIHUDSSRSTMW-UHFFFAOYSA-N
Smiles	CCCNC1=CC(=C(C=C1[N+](=O)[O-])Br)OCC
Isomeric SMILES	CCCNC1=CC(=C(C=C1[N+](=O)[O-])Br)OCC
PubChem CID	53216250
Molecular Weight	303.2

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	303.150 g/mol
XLogP3	4.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	302.027 Da
Monoisotopic Mass	302.027 Da
Topological Polar Surface Area	67.100 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	247.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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