4-클로로페닐 클로로포메이트 - ≥98% , CAS No.7693-45-0

CAS: 7693-45-0 Cat. No.: C139256 분자식: ClCO₂C₆H₄Cl 분자량: 191.01 EC 번호: 626-526-6

등급 & 순도 ≥98%

Synonyms

AKOS015891076 | 4-Chlorophenyl carbonochloridate | p-Chlorophenyl chloroformate | 4-Chlorophenyl carbonochloridate; 4-Chlorophenyl chloroformate | DTXSID60227716 | MFCD00000638 | C2545 | 4-Chlorophenyl chloridocarbonate | 4-CHLOROPHENYLCHLOROFORMATE | STR

Storage

2-8°C, 아르곤 충전 상태로 보관

Shipped In

젖은 얼음

개요

N-하이드록시-N-메틸카바메이트 4-클로로페닐 에스테르의 제조에 사용되었습니다.

사양

동의어

AKOS015891076 | 4-Chlorophenyl carbonochloridate | p-Chlorophenyl chloroformate | 4-Chlorophenyl carbonochloridate; 4-Chlorophenyl chloroformate | DTXSID60227716 | MFCD00000638 | C2545 | 4-Chlorophenyl chloridocarbonate | 4-CHLOROPHENYLCHLOROFORMATE | STR

사양 및 순도

≥98%

보관 조건

2-8°C, 아르곤 충전 상태로 보관

배송

젖은 얼음

순수함

≥98%

이름과 식별자

Pubchem Sid

508809510

정식 스마일

C1=CC(=CC=C1OC(=O)Cl)Cl

IUPAC Name

(4-chlorophenyl) carbonochloridate

InChIKey

RYWGPCLTVXMMHO-UHFFFAOYSA-N

INCHI

1S/C7H4Cl2O2/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H

이성체 SMILES

C1=CC(=CC=C1OC(=O)Cl)Cl

WGK 독일

3

분자량

191.01

Reaxy-Rn

1867968

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1867968&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Phenoxy compounds

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Phenoxy compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenoxy compounds
• Alternative Parents: Chlorobenzenes Aryl chlorides Organic carbonic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Carbonic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenoxy compounds. These are aromatic compounds contaning a phenoxy 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

• 용해성: It is soluble in organic solvents.
• 감도: Moisture Sensitive,Heat Sensitive
• 굴절률: 1.53
• 발화점(°F): 217.4 °F
• 발화점(°C): 103 °C
• 끓는점(°C): 102 °C/12 mmHg
• 분자량: 191.010 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 189.959 Da
• Monoisotopic Mass: 189.959 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 141.000
• 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