2-chloro-3-methylphenol - ≥97% , CAS No.608-26-4

CAS: 608-26-4 Cat. No.: C635993 분자식: C₇H₇ClO 분자량: 142.58 EC 번호: 210-156-3 PubChem CID: 14852

GRADE & PURITY ≥97%

Synonyms

m-Cresol, 2-chloro- | o-chloro-m-cresol | CL9093 | HKHXLHGVIHQKMK-UHFFFAOYSA-N | AKOS006273485 | SCHEMBL546021 | 2-Chloro-m-cresol | Chlormetakresol | EINECS 210-156-3 | UNII-XZT2VD3JL6 | MFCD00036178 | Phenol, 2-chloro-3-methyl- | AS-46206 | Phenol, chlo

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

동의어

m-Cresol, 2-chloro- | o-chloro-m-cresol | CL9093 | HKHXLHGVIHQKMK-UHFFFAOYSA-N | AKOS006273485 | SCHEMBL546021 | 2-Chloro-m-cresol | Chlormetakresol | EINECS 210-156-3 | UNII-XZT2VD3JL6 | MFCD00036178 | Phenol, 2-chloro-3-methyl- | AS-46206 | Phenol, chlo

사양 및 순도

≥97%

보관 조건

Room temperature

배송

FedEx DG Service

순수함

≥97%

이름과 식별자

정식 스마일

CC1=C(C(=CC=C1)O)Cl

IUPAC Name

2-chloro-3-methylphenol

InChIKey

HKHXLHGVIHQKMK-UHFFFAOYSA-N

INCHI

1S/C7H7ClO/c1-5-3-2-4-6(9)7(5)8/h2-4,9H,1H3

이성체 SMILES

CC1=C(C(=CC=C1)O)Cl

대체 CAS

608-26-4

PubChem CID

14852

UN 번호

3437

포장 그룹

II

분자량

142.58

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Phenols
      • Subclass Cresols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Phenols
• Subclass: Cresols
• Intermediate Tree Nodes: Not available
• Direct Parent: Meta cresols
• Alternative Parents: O-chlorophenols Toluenes Chlorobenzenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Organooxygen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 2-halophenol - M-cresol - 2-chlorophenol - Chlorobenzene - Halobenzene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as meta cresols. These are aromatic compounds containing a meta-cresol moiety, which consists of a benzene ring bearing a methyl group and a hydroxyl group at ring positions 1 and 3, respectively.
• External Descriptors: Not available

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(비인간)

Staphylococcus aureus (210822 Activities)

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

작용 메커니즘

화학 및 물리적 특성

• 분자량: 142.580 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 142.019 Da
• Monoisotopic Mass: 142.019 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 94.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• 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

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 608-26-4, the molecular formula is C7H7ClO, and the molecular weight is 142.58 g/mol. InChIKey HKHXLHGVIHQKMK-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.