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2,2-Dibromo-2-cyanoacetamide - ≥98.0%, high purity , CAS No.10222-01-2

COA

Grade & Purity:

≥98%

Cas Number: 10222-01-2
Molecular Weight: 241.87
MDL number: MFCD00129791
PubChem CID: 25059

In stock

Item Number

D154876

Grouped product items
SKU	Size	Availability	Price
D154876-5g	5g	2	$9.90
D154876-25g	25g	3	$18.90
D154876-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$64.90
D154876-500g	500g	2	$110.90

View related series

amide (313) Non heterocyclic block (8163)

Basic Description

Synonyms	Acetamide,2-dibromo-2-cyano- \| EINECS 233-539-7 \| DTXSID5032361 \| 2,2-DIBROMO-3-NITRILOPROPIONAMIDE [HSDB] \| BRN 1761192 \| 2,2-Dibromo-3-Nitrilo propionamide (DBNPA) \| Tox21_300089 \| 2,2-DIBROMO-2-CYANOACETAMIDE \| 2,2-dibromo-2-cyano-acetamide \| 2,2-Dibro
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Carboxylic acid derivatives
      - Level5 Carboxylic acid amides
        Level6 Primary carboxylic acid amides

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Carboxylic acid derivatives
Intermediate Tree Nodes	Carboxylic acid amides
Direct Parent	Primary carboxylic acid amides
Alternative Parents	Nitriles Organopnictogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Primary carboxylic acid amide - Carbonitrile - Nitrile - Alkyl bromide - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
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

Associated Targets(Human)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NFKB1 Tclin Nuclear factor NF-kappa-B p105 subunit (1459 Activities)

Discover Target: NFKB1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TP53 Tchem Cellular tumor antigen p53 (48468 Activities)

Discover Target: TP53

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	2,2-dibromo-2-cyanoacetamide
INCHI	InChI=1S/C3H2Br2N2O/c4-3(5,1-6)2(7)8/h(H2,7,8)
InChIKey	UUIVKBHZENILKB-UHFFFAOYSA-N
Smiles	C(#N)C(C(=O)N)(Br)Br
Isomeric SMILES	C(#N)C(C(=O)N)(Br)Br
WGK Germany	3
RTECS	AB5956000
UN Number	2923
Packing Group	I
Molecular Weight	241.87
Reaxy-Rn	1761192
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1761192&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
H2205074	Certificate of Analysis	May 12, 2025	D154876
H2205075	Certificate of Analysis	May 12, 2025	D154876
H2205073	Certificate of Analysis	May 12, 2025	D154876
H2205072	Certificate of Analysis	May 12, 2025	D154876
K1720024	Certificate of Analysis	Jul 07, 2023	D154876
F1705095	Certificate of Analysis	Feb 06, 2023	D154876
G1908171	Certificate of Analysis	May 06, 2022	D154876
C2225034	Certificate of Analysis	Mar 29, 2022	D154876

Chemical and Physical Properties

Solubility	Slightly soluble in water; Degree of Solubility in water: 15 g/l; Soluble in Methanol,Acetone,Ethanol; Slightly soluble in Benzene,Toluene
Sensitivity	Moisture sensitive
Melt Point(°C)	125 °C
Molecular Weight	241.870 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	241.851 Da
Monoisotopic Mass	239.853 Da
Topological Polar Surface Area	66.900 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	156.000
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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