1-Ethoxy-2-propanol - ≥99% , CAS No.1569-02-4

CAS: 1569-02-4 Cat. No.: E110143 분자식: C₅H₁₂O₂ 분자량: 104.15 EC 번호: 216-374-5

등급 & 순도 ≥99%

Synonyms

1-Ethoxy-2-propanol | CAS-1569-02-4 | 1-Ethoxy-2-propanol, AldrichCPR | EINECS 216-374-5 | Q27288224 | EN300-177730 | EC 216-374-5 | DTXSID1041267 | E0446 | 1-ethoxy-propan-2-ol | 1-Ethoxypropan-2-ol | NCGC00255623-01 | DTXCID404283 | LS-13093 | NSC 2404

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

사양

동의어

1-Ethoxy-2-propanol | CAS-1569-02-4 | 1-Ethoxy-2-propanol, AldrichCPR | EINECS 216-374-5 | Q27288224 | EN300-177730 | EC 216-374-5 | DTXSID1041267 | E0446 | 1-ethoxy-propan-2-ol | 1-Ethoxypropan-2-ol | NCGC00255623-01 | DTXCID404283 | LS-13093 | NSC 2404

사양 및 순도

≥99%

보관 조건

Store at 2-8°C

배송

Wet ice,FedEx DG Service

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순수함

≥99%

이름과 식별자

Pubchem Sid

504752650

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752650

정식 스마일

CCOCC(C)O

IUPAC Name

1-ethoxypropan-2-ol

InChIKey

JOLQKTGDSGKSKJ-UHFFFAOYSA-N

INCHI

1S/C5H12O2/c1-3-7-4-5(2)6/h5-6H,3-4H2,1-2H3

이성체 SMILES

CCOCC(C)O

RTECS

UB5250000

UN 번호

1987

포장 그룹

III

분자량

104.15

Reaxy-Rn

1732213

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732213&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Ether - Dialkyl ether - Hydrocarbon derivative - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
• 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: Miscible with water.
• 굴절률: 1.4050 to 1.4080
• 발화점(°C): 38°C
• 끓는점(°C): 132 °C
• 녹는점(°C): -90 °C
• 분자량: 104.150 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 104.084 Da
• Monoisotopic Mass: 104.084 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 37.100
• 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