1,6-Dioxacyclododecane-7,12-dione - ≥95% , CAS No.777-95-7

CAS: 777-95-7 Cat. No.: D333629 Molecular Weight: 200.23 EC Number: 212-291-3
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
DTXSID70228330 | AKOS028114726 | AS-61225 | butylene adipate | K085AS8U9A | UNII-K085AS8U9A | 1,6-DIOXACYCLODODECANE- 7,12-DION | Q27281769 | 1,6-DIOXACYCLODODECANE-7,12-DIONE | Adipic Acid Cyclic Tetramethylene Ester | EINECS 212-291-3 | AXKZIDYFAMKWSA-U
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
D333629-100mg
2

$117.90

$139.90
Save $22.00 (15.73%)
250mg
D333629-250mg
3

$235.90

$291.90
Save $56.00 (19.18%)
1g
D333629-1g
3
$708.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Application:

1,6-Dioxacyclododecane-7,12-dione, is on of the Macrocyclic compounds. It can be used in the preparation of other Symmetrical cyclic diesters and dilactones.

Specifications

Synonyms
DTXSID70228330 | AKOS028114726 | AS-61225 | butylene adipate | K085AS8U9A | UNII-K085AS8U9A | 1, 6-DIOXACYCLODODECANE- 7, 12-DION | Q27281769 | 1, 6-DIOXACYCLODODECANE-7, 12-DIONE | Adipic Acid Cyclic Tetramethylene Ester | EINECS 212-291-3 | AXKZIDYFAMKWSA-U
Specifications & Purity
≥95%
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Pubchem Sid504752422
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752422
Canonical SmilesC1CCC(=O)OCCCCOC(=O)C1
IUPAC Name1,6-dioxacyclododecane-7,12-dione
InChIKeyAXKZIDYFAMKWSA-UHFFFAOYSA-N
INCHI1S/C10H16O4/c11-9-5-1-2-6-10(12)14-8-4-3-7-13-9/h1-8H2
Isomeric SMILES C1CCC(=O)OCCCCOC(=O)C1
Molecular Weight 200.23
Reaxy-Rn 1344590
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1344590&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.

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
SuperclassPhenylpropanoids and polyketides
ClassMacrolides and analogues
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentMacrolides and analogues
Alternative Parents Dicarboxylic acids and derivatives  Lactones  Carboxylic acid esters  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Macrolide - Dicarboxylic acid or derivatives - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as macrolides and analogues. These are organic compounds containing a lactone ring of at least twelve members.
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.

3 results found

Lot NumberCertificate TypeDateItem
J2214376Certificate of AnalysisJul 15, 2025 D333629
J2214377Certificate of AnalysisJul 15, 2025 D333629
J2214700Certificate of AnalysisJul 15, 2025 D333629
Chemical and Physical Properties
SolubilitySoluble in chloroform, ethyl acetate, and methanol.
Refractive Indexn20D1.44 (Predicted)
Boil Point(°C)~422.3° C at 760 mmHg (Predicted)
Melt Point(°C)90-93°C
Molecular Weight200.230 g/mol
XLogP31.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass200.105 Da
Monoisotopic Mass200.105 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count14
Formal Charge0
Complexity178.000
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
Citations of This Product
References
1. Chuang-Chuang Zhao, Qin-Bao Lin, Cang-Hao Xie, Yi-Qi Liu, Huai-Ning Zhong, Wei-Yue Gu, David Julian McClements, Da Ma.  (2024)  Screening and safety assessment of migrating substances released from biodegradable packaging materials into milk.  FOOD CONTROL,      [PMID:] [10.1016/j.foodcont.2024.110755]
Solution Calculators
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