Dihydrocoumarin - 10mM in DMSO , CAS No.119-84-6

CAS: 119-84-6 Cat. No.: D420880 분자식: C9H8O2 분자량: 148.16 Beilstein Registry Number: 17315 EC 번호: 204-354-9
주문 가능
GRADE & PURITY 10mM in DMSO
Synonyms
2,3-dihydrocoumarin | 3,4-dihydrocoumarin | Dihydrocoumarin, 99% | InChI=1/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H | Oxochroman | BRN 0004584 | FT-0614320 | melilotic lactone | MELILOTIN [HSDB] | SMR000112325 | CHEBI:16151 | VS-08570 | CAS-119-84-6
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
Size
USA
독일 (EU)*
Price
Qty
1ml
D420880-1ml
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US$69.90
저장 US$11.00 (15.74%)
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

Cited in 6 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
2,3-dihydrocoumarin | 3,4-dihydrocoumarin | Dihydrocoumarin, 99% | InChI=1/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H | Oxochroman | BRN 0004584 | FT-0614320 | melilotic lactone | MELILOTIN [HSDB] | SMR000112325 | CHEBI:16151 | VS-08570 | CAS-119-84-6
사양 및 순도
10mM in DMSO
보관 조건
Store at -80°C
배송
Dry ice packs + Cold packs
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이름과 식별자
Pubchem Sid528769636
정식 스마일C1CC(=O)OC2=CC=CC=C21
IUPAC Name3,4-dihydrochromen-2-one
InChIKeyVMUXSMXIQBNMGZ-UHFFFAOYSA-N
INCHI1S/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2
이성체 SMILES C1CC(=O)OC2=CC=CC=C21
WGK 독일 3
RTECS MW5775000
분자량 148.16
Beilstein 17315
Reaxy-Rn 4584
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4584&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
분류3,4-dihydrocoumarins
SubclassNot available
Intermediate Tree Nodes Not available
Direct Parent3,4-dihydrocoumarins
Alternative Parents 1-benzopyrans  Benzenoids  Lactones  Carboxylic acid esters  Oxacyclic compounds  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 3,4-dihydrocoumarin - Chromane - Benzopyran - 1-benzopyran - Benzenoid - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as 3,4-dihydrocoumarins. These are 3,4-dihydrogenated coumarins. Coumarin is a bicyclic compound that a 1-benzopyran carrying an oxo group at the 2-position.
External Descriptors an aromatic compound
3D 구조
상호 작용 화학 구조 모델





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작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
동결점(°C)22 °C
굴절률1.556
발화점(°F)235.4 °F
발화점(°C)113 °C
끓는점(°C)272 °C
녹는점(°C)24-25°C
분자량148.160 g/mol
XLogP31.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass148.052 Da
Monoisotopic Mass148.052 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count11
Formal Charge0
Complexity165.000
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
자주 묻는 질문과 기사
Citations of This Product
참고 문헌
1. Yin Lu, Nan Li, Yaliang Peng, Mohamed Gamal Mohamed, Shiao-Wei Kuo, Kan Zhang.  (2023)  Facile and eco-friendly synthesis of hydrogen bonding-rich bio-based bisbenzoxazine resins with low surface free energy, strong adhesion strength and high thermal stability.  Molecular Systems Design & Engineering,  (1): (86-98).  [PMID:] [10.1039/D3ME00066D]
2. Yuanlong Guo, Gu Guo, Pengcheng Liu, Yang You, Jili Yuan, Gang Hu, Lei Dai, Michael North, Haibo Xie, Qiang Zheng.  (2023)  The synthesis of multifunctional cellulose graft alternating copolymers of 3,4-dihydrocoumarin and epoxides in DBU/DMSO/CO2 solvent system.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:37648137] [10.1016/j.ijbiomac.2023.126584]
3. Pengcheng Liu, Yuanlong Guo, Gu Guo, Lei Dai, Gang Hu, Haibo Xie.  (2023)  Lignin-grafting alternative copolymer of 3,4-dihydrocoumarin and epoxides as an active and flexible ingredient in sunscreen.  GREEN CHEMISTRY,  25  (11): (4469-4481).  [PMID:] [10.1039/D3GC00531C]
4. Shasha Jing, Huijun Zheng, Li Zhao, Lingbo Qu, Lanlan Yu.  (2017)  A sensitive sodium dodecyl sulfonate functionalized graphene hybrid SnO2 nanoparticles composite modified glassy carbon electrode for detecting daphnetin.  JOURNAL OF ELECTROANALYTICAL CHEMISTRY,      [PMID:] [10.1016/j.jelechem.2017.01.027]
5. Yuanlong Guo, Juchun Liu, Tianlong He, Tao Wu, Tonghui Xu, Yunqi Li, Haibo Xie.  (2025)  A strategy of achieving two things at one stroke toward the lignin-based furfural resin for adhesive and photothermal conversion materials.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:40044001] [10.1016/j.ijbiomac.2025.141710]
6. Qianqian Liang, Xin Jiang, Dajun Wang, Shumin Zhang, Qifei Hua, Wenzheng Shi.  (2025)  Screening of natural myofibril-bound serine protease inhibitors based on molecular docking and their effects on the quality of surimi gels.  FOOD CHEMISTRY,      [PMID:40580600] [10.1016/j.foodchem.2025.145314]
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