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· · COA & SDS 모든 제품에 대한 사용 가능 · 주식 상품에 대한 같은 날 배송 4-Methylpyrocatechol - ≥96% , CAS No.452-86-8
Storage
Room temperature,Argon charged
개요 Application
4-Methylcatechol is used to synthesize antimicrobial, antioxidant. It also acts as effective inhibitor. It can be used to produce 4-bromo-5-methyl-pyrocatechol. It Increases Brain-Derived Neurotrophic Factor Content and mRNA Expression in Cultured Brain Cells and in Rat Brain In Vivo.
사양 보관 조건
Room temperature,Argon charged
이름과 식별자 Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181057
IUPAC Name
4-methylbenzene-1,2-diol
InChIKey
ZBCATMYQYDCTIZ-UHFFFAOYSA-N
INCHI
1S/C7H8O2/c1-5-2-3-6(8)7(9)4-5/h2-4,8-9H,1H3
이성체 SMILES
CC1=CC(=C(C=C1)O)O
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636512&ln=
고급 데이터 Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids 분류 Phenols Subclass Benzenediols Intermediate Tree Nodes Not available Direct Parent Catechols Alternative Parents Para cresols Meta cresols Toluenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents P-cresol - M-cresol - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound 설명 This compound belongs to the class of organic compounds known as catechols. These are compounds containing a 1,2-benzenediol moiety. External Descriptors a catechol 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.
3D 구조 관련 대상(인간) 관련 대상(비인간) 작용 메커니즘 인증서(CoA, COO, BSE/TSE 및 분석 차트) 화학 및 물리적 특성 용해성 Soluble in water, methanol, acetone, ether, and alcohol. 감도 Light & Air Sensitive;Moisture sensitive 발화점(°F) 284 °F 발화점(°C) 140 °C 끓는점(°C) 251°C 녹는점(°C) 67-69°C 분자량 124.140 g/mol XLogP3 1.400 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 124.052 Da Monoisotopic Mass 124.052 Da Topological Polar Surface Area 40.500 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 92.900 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
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