Dimethyl 2,5-dibromohexanedioate - ≥97% , CAS No.868-72-4

CAS: 868-72-4 Cat. No.: D351115 분자식: C8H12Br2O4 분자량: 331.99 EC 번호: 620-699-1
주문 가능
GRADE & PURITY ≥97%
Synonyms
AKOS000280745 | Dimethyl 2,2'-dibromoadipate | AS-18580 | SCHEMBL1415237 | Amgard TOF | HVICCJCVLLCDFQ-UHFFFAOYSA-N | DTXSID30968220 | dimethyl 2,5-dibromo hexanedioate | 4-02-00-00849 (Beilstein Handbook Reference) | Dimethyl-2,5-Dibromoadipate | Dimethy
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
1g
D351115-1g
주문제작 · 8~12주
US$9.90
5g
D351115-5g
주문제작 · 8~12주
US$11.90
25g
D351115-25g
주문제작 · 8~12주
US$34.90
100g
D351115-100g
주문제작 · 8~12주
US$64.90
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
AKOS000280745 | Dimethyl 2,2'-dibromoadipate | AS-18580 | SCHEMBL1415237 | Amgard TOF | HVICCJCVLLCDFQ-UHFFFAOYSA-N | DTXSID30968220 | dimethyl 2,5-dibromo hexanedioate | 4-02-00-00849 (Beilstein Handbook Reference) | Dimethyl-2,5-Dibromoadipate | Dimethy
사양 및 순도
≥97%
보관 조건
Store at 2-8°C,Argon charged
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
순수함
≥97%
이름과 식별자
정식 스마일
COC(=O)C(CCC(C(=O)OC)Br)Br
IUPAC Name
dimethyl 2,5-dibromohexanedioate
InChIKey
HVICCJCVLLCDFQ-UHFFFAOYSA-N
INCHI
1S/C8H12Br2O4/c1-13-7(11)5(9)3-4-6(10)8(12)14-2/h5-6H,3-4H2,1-2H3
이성체 SMILES
COC(=O)C(CCC(C(=O)OC)Br)Br
분자량
331.99
Reaxy-Rn
1727129
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1727129&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
SuperclassLipids and lipid-like molecules
분류Fatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Dicarboxylic acids and derivatives  Methyl esters  Alpha-halocarboxylic acid derivatives  Organobromides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl bromides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Dicarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Alkyl bromide - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Aliphatic acyclic compound
설명This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
녹는점(°C)74-76° C
분자량331.990 g/mol
XLogP32.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass331.908 Da
Monoisotopic Mass329.91 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count14
Formal Charge0
Complexity186.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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