2-Butoxypyridine - ≥97%(GC) , CAS No.27361-16-6

CAS: 27361-16-6 Cat. No.: B152891 분자식: C₉H₁₃NO 분자량: 151.21 Beilstein Registry Number: 21(5)2,4 EC 번호: 248-428-9

GRADE & PURITY ≥97%(GC)

Synonyms

AS-56769 | B1925 | CBA36116 | EINECS 248-428-9 | EN300-19703 | NSC 30253 | InChI=1/C9H13NO/c1-2-3-8-11-9-6-4-5-7-10-9/h4-7H,2-3,8H2,1H | Butyl 2-pyridyl ether | MFCD00006267 | DTXSID10181793 | J-016749 | Pyridine, 2-butoxy- | FT-0638696 | SB53791 | NSC302

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

AS-56769 | B1925 | CBA36116 | EINECS 248-428-9 | EN300-19703 | NSC 30253 | InChI=1/C9H13NO/c1-2-3-8-11-9-6-4-5-7-10-9/h4-7H,2-3,8H2,1H | Butyl 2-pyridyl ether | MFCD00006267 | DTXSID10181793 | J-016749 | Pyridine, 2-butoxy- | FT-0638696 | SB53791 | NSC302

사양 및 순도

≥97%(GC)

보관 조건

Room temperature

배송

Normal

순수함

≥97%(GC)

이름과 식별자

정식 스마일

CCCCOC1=CC=CC=N1

IUPAC Name

2-butoxypyridine

InChIKey

OFLSKXBALZCMCX-UHFFFAOYSA-N

INCHI

1S/C9H13NO/c1-2-3-8-11-9-6-4-5-7-10-9/h4-7H,2-3,8H2,1H3

이성체 SMILES

CCCCOC1=CC=CC=N1

WGK 독일

3

분자량

151.21

Beilstein

21(5)2,4

Reaxy-Rn

117257

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=117257&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
• 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

• 굴절률: 1.48
• 발화점(°F): 167 °F
• 발화점(°C): 75°C(lit.)
• 끓는점(°C): 200 °C
• 분자량: 151.210 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 151.1 Da
• Monoisotopic Mass: 151.1 Da
• Topological Polar Surface Area: 22.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 95.600
• 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, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). 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 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 27361-16-6, the molecular formula is C9H13NO, and the molecular weight is 151.21 g/mol. InChIKey OFLSKXBALZCMCX-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.