Benzoin methyl ether - ≥98% , CAS No.3524-62-7

CAS: 3524-62-7 Cat. No.: B104003 분자식: C₁₅H₁₄O₂ 분자량: 226.27 Beilstein Registry Number: 2052112 EC 번호: 222-538-7

GRADE & PURITY ≥98%

Synonyms

alpha-Methoxybenzyl phenyl ketone | (+/-)-METHYL BENZOIN | 1H-PYRAZOL-3-AMINE, 5-ETHYL- | Benzoin methyl ester | Benzoin methyl ether | Benzoin methyl ether, 96% | O-Methylbenzoin | alpha-Methoxydeoxybenzoin | Benzoin methyl ether, 98% | Nisso Cure MBO |

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

동의어

alpha-Methoxybenzyl phenyl ketone | (+/-)-METHYL BENZOIN | 1H-PYRAZOL-3-AMINE, 5-ETHYL- | Benzoin methyl ester | Benzoin methyl ether | Benzoin methyl ether, 96% | O-Methylbenzoin | alpha-Methoxydeoxybenzoin | Benzoin methyl ether, 98% | Nisso Cure MBO |

사양 및 순도

≥98%

보관 조건

Argon charged,Room temperature

배송

Normal

순수함

≥98%

이름과 식별자

• Pubchem Sid: 504756388
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756388
• 정식 스마일: COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
• IUPAC Name: 2-methoxy-1,2-diphenylethanone
• InChIKey: BQZJOQXSCSZQPS-UHFFFAOYSA-N
• INCHI: 1S/C15H14O2/c1-17-15(13-10-6-3-7-11-13)14(16)12-8-4-2-5-9-12/h2-11,15H,1H3
• 이성체 SMILES: COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
• WGK 독일: 3
• RTECS: AM9350000
• UN 번호: 2811
• 분자량: 226.27
• Beilstein: 2052112
• Reaxy-Rn: 2052112
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2052112&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • 분류 Stilbenes
      • Subclass Benzoins

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• 분류: Stilbenes
• Subclass: Benzoins
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoins
• Alternative Parents: Alkyl-phenylketones Benzylethers Benzoyl derivatives Aryl alkyl ketones Dialkyl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzoin - Alkyl-phenylketone - Phenylketone - Benzylether - Benzoyl - Aryl alkyl ketone - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Ketone - Ether - Dialkyl ether - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as benzoins. These are organic compounds containing a 1,2-hydroxy ketone attached to two phenyl groups.
• 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

화학 및 물리적 특성

• 용해성: Soluble in methanol.
• 감도: Moisture & air sensitive.
• 발화점(°F): 110 °C
• 발화점(°C): 110°C
• 끓는점(°C): 188-189°C
• 녹는점(°C): 49°C
• 분자량: 226.270 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 226.099 Da
• Monoisotopic Mass: 226.099 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 237.000
• 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

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 should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 3524-62-7, the molecular formula is C15H14O2, and the molecular weight is 226.27 g/mol. InChIKey BQZJOQXSCSZQPS-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.