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3-Iodobenzhydrazide - 95%, high purity , CAS No.39115-94-1

COA

Grade & Purity:

≥95%

Cas Number: 39115-94-1
Molecular Weight: 262.05
MDL number: MFCD00270106
PubChem CID: 615774

In stock

Item Number

I300212

Grouped product items
SKU	Size	Availability	Price	Qty
I300212-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$32.90
I300212-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$105.90

Discover 3-Iodobenzhydrazide by Aladdin Scientific in 95% for only $32.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-Iodobenzohydrazide \| 3-Iodobenzhydrazide \| 39115-94-1 \| MFCD00270106 \| 3-Iodo-benzoic acid hydrazide \| 3-Iodobenzohydrazide # \| SCHEMBL2293623 \| DTXSID00346854 \| STK083342 \| AKOS000484016 \| SB85920 \| AS-57109 \| SY078956 \| CS-0062065 \| FT-0676454 \| W17411 \| EN300-1262919 \| A824408 \| AE-641
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Halobenzoic acids and derivatives
        Level6 3-halobenzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Halobenzoic acids and derivatives
Direct Parent	3-halobenzoic acids and derivatives
Alternative Parents	Benzoyl derivatives Iodobenzenes Aryl iodides Carboxylic acid hydrazides Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	3-halobenzoic acid or derivatives - Benzoyl - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Carboxylic acid hydrazide - Carboxylic acid derivative - Organic nitrogen compound - Organoiodide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of 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	3-iodobenzohydrazide
INCHI	InChI=1S/C7H7IN2O/c8-6-3-1-2-5(4-6)7(11)10-9/h1-4H,9H2,(H,10,11)
InChIKey	SSWUMULSRFHKKU-UHFFFAOYSA-N
Smiles	C1=CC(=CC(=C1)I)C(=O)NN
Isomeric SMILES	C1=CC(=CC(=C1)I)C(=O)NN
Molecular Weight	262.05
Reaxy-Rn	1945821
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1945821&ln=

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Lot Number	Certificate Type	Date	Item
H2106490	Certificate of Analysis	May 10, 2023	I300212

Chemical and Physical Properties

Melt Point(°C)	151-153°
Molecular Weight	262.050 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	261.96 Da
Monoisotopic Mass	261.96 Da
Topological Polar Surface Area	55.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151.000
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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