Sebaconitrile - ≥98% , CAS No.1871-96-1

CAS: 1871-96-1 Cat. No.: S110880 Molecular Weight: 164.25 Beilstein Registry Number: 1750739 EC Number: 217-494-0 PubChem CID: 74639
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
FT-0693917 | W-107773 | AKOS009031604 | EINECS 217-494-0 | Oktamethylendikyanid [Czech] | NSC39461 | EN300-19662 | BRN 1750739 | octamethylendicyanid | 9H-Fluoren-9-one, 2-amino- (9CI) | UNII-6S84VV9MLG | LS-13841 | NSC 39461 | Octane-1,8-dicarbonitrile |
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5ml
S110880-5ml
2
$23.90
25ml
S110880-25ml
4
$84.90
100ml
S110880-100ml
1
$205.90
500ml
S110880-500ml
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$908.90
Enter a quantity for the sizes you want to add.
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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
FT-0693917 | W-107773 | AKOS009031604 | EINECS 217-494-0 | Oktamethylendikyanid [Czech] | NSC39461 | EN300-19662 | BRN 1750739 | octamethylendicyanid | 9H-Fluoren-9-one, 2-amino- (9CI) | UNII-6S84VV9MLG | LS-13841 | NSC 39461 | Octane-1, 8-dicarbonitrile |
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488184957
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488184957
Canonical SmilesC(CCCCC#N)CCCC#N
IUPAC Namedecanedinitrile
InChIKeyDFJYZCUIKPGCSG-UHFFFAOYSA-N
INCHI1S/C10H16N2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-8H2
Isomeric SMILES C(CCCCC#N)CCCC#N
WGK Germany 3
RTECS VS1500000
PubChem CID 74639
Molecular Weight 164.25
Beilstein 1750739
Reaxy-Rn 1750739

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.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic nitrogen compounds
ClassOrganonitrogen compounds
SubclassOrganic cyanides
Intermediate Tree Nodes Not available
Direct ParentNitriles
Alternative Parents Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





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.

7 results found

Lot NumberCertificate TypeDateItem
H1802135Certificate of AnalysisMar 20, 2026 S110880
C2225041Certificate of AnalysisJan 19, 2026 S110880
A2609078Certificate of AnalysisAug 27, 2025 S110880
H2518145Certificate of AnalysisAug 27, 2025 S110880
B2401009Certificate of AnalysisMar 30, 2022 S110880
D23261103Certificate of AnalysisMar 30, 2022 S110880
B2211034Certificate of AnalysisFeb 24, 2022 S110880
Chemical and Physical Properties
SolubilityInsoluble in water; Soluble in Chloroform
Freezing Point(°C)7 °C
Refractive Index1.4474
Flash Point(°F)113 °C
Flash Point(°C)113°C
Boil Point(°C)204°C
Melt Point(°C)7°C
Molecular Weight164.250 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass164.131 Da
Monoisotopic Mass164.131 Da
Topological Polar Surface Area47.600 Ų
Heavy Atom Count12
Formal Charge0
Complexity157.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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