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4-Bromo-5-fluoro-2-nitro-N-propylaniline - 95%, high purity , CAS No.1261927-35-8

COA

Grade & Purity:

≥95%

Cas Number: 1261927-35-8
Molecular Weight: 377.1
PubChem CID: 53216245

In stock

Item Number

B180865

Grouped product items
SKU	Size	Availability	Price
B180865-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,154.90
B180865-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,245.90
B180865-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$4,464.90

Discover 4-Bromo-5-fluoro-2-nitro-N-propylaniline by Aladdin Scientific in 95% for only $1,154.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-BROMO-5-FLUORO-2-NITRO-N-PROPYLANILINE \| 1261927-35-8 \| DTXSID10681501 \| MFCD18311824 \| AKOS015157190 \| BS-20231 \| CS-0443555 \| A889567 \| Benzenamine, 4-bromo-5-fluoro-2-nitro-N-propyl-
Specifications & Purity	≥95%
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	Nitrobenzenes
Alternative Parents	Aniline and substituted anilines Phenylalkylamines Nitroaromatic compounds Secondary alkylarylamines Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Organobromides Organofluorides Organic oxides Organopnictogen compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Phenylalkylamine - Bromobenzene - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl halide - Aryl bromide - Aryl fluoride - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organobromide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organofluoride - Organonitrogen compound - Organopnictogen compound - Organic salt - Organic zwitterion - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
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-fluoro-2-nitro-N-propylaniline
INCHI	InChI=1S/C9H10BrFN2O2/c1-2-3-12-8-5-7(11)6(10)4-9(8)13(14)15/h4-5,12H,2-3H2,1H3
InChIKey	OQKJMCBZXPDHHY-UHFFFAOYSA-N
Smiles	CCCNC1=CC(=C(C=C1[N+](=O)[O-])Br)F
Isomeric SMILES	CCCNC1=CC(=C(C=C1[N+](=O)[O-])Br)F
PubChem CID	53216245
Molecular Weight	377.1

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	277.090 g/mol
XLogP3	4.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	275.991 Da
Monoisotopic Mass	275.991 Da
Topological Polar Surface Area	57.900 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	225.000
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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