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Diisopropylcyanamide - ≥98% , CAS No.3085-76-5

Diisopropylcyanamide - ≥98% , CAS No.3085-76-5

Name: Diisopropylcyanamide - ≥98% , CAS No.3085-76-5
Brand: Aladdin Scientific
SKU: D154650
Availability: InStock

CAS: 3085-76-5 Cat. No.: D154650 Molecular Weight: 126.2 EC Number: 221-401-9

COA

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Diisopropylcyanamide - ≥98% CAS No(3085-76-5) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY ≥98%

Synonyms

Storage

Room temperature

Shipped In

Normal

Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

Pubchem Sid	504755073
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504755073
Canonical Smiles	CC(C)N(C#N)C(C)C
IUPAC Name	di(propan-2-yl)cyanamide
InChIKey	DGCUISYKMONQDH-UHFFFAOYSA-N
INCHI	1S/C7H14N2/c1-6(2)9(5-8)7(3)4/h6-7H,1-4H3
Isomeric SMILES	CC(C)N(C#N)C(C)C
Molecular Weight	126.2
Reaxy-Rn	1745393
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1745393&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organonitrogen compounds
Alternative Parents	Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organonitrogen compounds. These are organic compounds containing a nitrogen atom.
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

3D Structure

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.

2 results found

Lot Number	Certificate Type	Date	Item
C23101356	Certificate of Analysis	Feb 10, 2023	D154650
C23101366	Certificate of Analysis	Feb 10, 2023	D154650

Chemical and Physical Properties

Refractive Index	1.43
Flash Point(°C)	79 °C
Boil Point(°C)	94°C/25mmHg(lit.)
Melt Point(°C)	-27°C(lit.)
Molecular Weight	126.200 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	126.116 Da
Monoisotopic Mass	126.116 Da
Topological Polar Surface Area	27.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	110.000
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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