Dichlorprop - ≥98% , CAS No.120-36-5

CAS: 120-36-5 Cat. No.: D114536 분자식: C₉H₈Cl₂O₃ 분자량: 235.06 Beilstein Registry Number: 6568822 EC 번호: 204-390-5

등급 & 순도 ≥98%

Synonyms

Dichlorprop|120-36-5|2-(2,4-Dichlorophenoxy)propanoic acid|2-(2,4-Dichlorophenoxy)propionic acid|DICHLOROPROP|Hormatox|Kildip|Celatox-dp|Herbizid DP|Hedonal DP|Cornox RK|Propanoic acid, 2-(2,4-dichlorophenoxy)-|Seritox 50|Weedone dp|2,4-DP|Canapur DP|Weed

Storage

Room temperature

Shipped In

FedEx DG Service

사양

동의어

Dichlorprop | 120-36-5 | 2-(2,4-Dichlorophenoxy)propanoic acid | 2-(2,4-Dichlorophenoxy)propionic acid | DICHLOROPROP | Hormatox | Kildip | Celatox-dp | Herbizid DP | Hedonal DP | Cornox RK | Propanoic acid, 2-(2,4-dichlorophenoxy)- | Seritox 50 | Weedone dp | 2,4-DP | Canapur DP | Weed

사양 및 순도

≥98%

보관 조건

Room temperature

배송

FedEx DG Service

순수함

≥98%

이름과 식별자

Pubchem Sid

504751676

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751676

정식 스마일

CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl

IUPAC Name

2-(2,4-dichlorophenoxy)propanoic acid

InChIKey

MZHCENGPTKEIGP-UHFFFAOYSA-N

INCHI

1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)

이성체 SMILES

CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl

WGK 독일

2

RTECS

UF1050000

UN 번호

3077(international)

포장 그룹

III

분자량

235.06

Beilstein

6568822

Reaxy-Rn

3203103

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3203103&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass 2-phenoxypropionic acids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: 2-phenoxypropionic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-phenoxypropionic acids
• Alternative Parents: Phenoxyacetic acid derivatives Phenoxy compounds Phenol ethers Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 2-phenoxypropionic acid - Phenoxyacetate - Phenoxy compound - Phenol ether - 1,3-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organochloride - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as 2-phenoxypropionic acids. These are aromatic compounds hat contain a phenol ether attached to the C2-atom of a phenylpropionic acid.
• External Descriptors: Auxins

Data sources

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

관련 대상(인간)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GABRA1 Tclin GABA-A receptor; alpha-1/beta-3/gamma-2 (1565 Activities)

Discover Target: GABRA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

관련 대상(비인간)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

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Zea mays (820 Activities)

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Trypanosoma cruzi (99888 Activities)

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L6 (7924 Activities)

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작용 메커니즘

화학 및 물리적 특성

• 녹는점(°C): 117.5-118.1°C
• 분자량: 235.060 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 233.985 Da
• Monoisotopic Mass: 233.985 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 210.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 120-36-5, the molecular formula is C9H8Cl2O3, and the molecular weight is 235.06 g/mol. InChIKey MZHCENGPTKEIGP-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.