1-Chloro-2-naphthol - ≥98% , CAS No.633-99-8

CAS: 633-99-8 Cat. No.: C405501 Summenformel: C₁₀H₇ClO Molekulargewicht: 178.62 EG-Nummer: 211-200-4

GRADE & PURITY ≥98%

Synonyms

BBL034800 | 2-Naphthalenol, 1-chloro- | NSC37026 | NSC-37026 | 1-Chloro-2-Naphthalenol | 1-Chloro-beta-naphthol | Chloro-2-naphthol | NSC 37026 | 1-chloro-naphthalen-2-ol | 1-chloronaphthalen-2-ol | PS-11606 | UNII-3CL4OW5YKB | 1-Chloro-2-hydroxynaphthale

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

BBL034800 | 2-Naphthalenol, 1-chloro- | NSC37026 | NSC-37026 | 1-Chloro-2-Naphthalenol | 1-Chloro-beta-naphthol | Chloro-2-naphthol | NSC 37026 | 1-chloro-naphthalen-2-ol | 1-chloronaphthalen-2-ol | PS-11606 | UNII-3CL4OW5YKB | 1-Chloro-2-hydroxynaphthale

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504752346

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752346

Kanonisches Lächeln

C1=CC=C2C(=C1)C=CC(=C2Cl)O

IUPAC Name

1-chloronaphthalen-2-ol

InChIKey

RMSOEGBYNWXXBG-UHFFFAOYSA-N

INCHI

1S/C10H7ClO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6,12H

Isomere SMILES

C1=CC=C2C(=C1)C=CC(=C2Cl)O

RTECS

QL3410000

Molekulargewicht

178.62

Reaxy-Rn

1939233

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1939233&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Naphthalenes
      • Subclass Naphthols and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Naphthalenes
• Subclass: Naphthols and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthols and derivatives
• Alternative Parents: Chloronaphthalenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Organooxygen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Chloronaphthalene - 2-naphthol - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Aryl chloride - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Methanol
• Siedepunkt (°C): 157 °C/16 mmHg
• Schmelzpunkt (°C): 68 °C
• Molekulargewicht: 178.610 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 178.019 Da
• Monoisotopic Mass: 178.019 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 160.000
• 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