4-Cyclopropylphenol - ≥98% , CAS No.10292-61-2

CAS: 10292-61-2 Cat. No.: C189395 Summenformel: C₉H₁₀O Molekulargewicht: 134.18 EG-Nummer: 876-090-8

GRADE & PURITY ≥98%

Synonyms

IGIWPHRUBXKMAR-UHFFFAOYSA-N | p-hydroxyphenylcyclopropane | SY035185 | AKOS004118880 | PS-5869 | EN300-1842412 | FT-0696396 | 4-Cyclopropyl phenol | Phenol, 4-cyclopropyl- | AMY23808 | BB 0223487 | DTXSID30450731 | SCHEMBL1865798 | MFCD06802405 | 4-Cyclop

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

IGIWPHRUBXKMAR-UHFFFAOYSA-N | p-hydroxyphenylcyclopropane | SY035185 | AKOS004118880 | PS-5869 | EN300-1842412 | FT-0696396 | 4-Cyclopropyl phenol | Phenol, 4-cyclopropyl- | AMY23808 | BB 0223487 | DTXSID30450731 | SCHEMBL1865798 | MFCD06802405 | 4-Cyclop

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

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

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 528760722
• Kanonisches Lächeln: C1CC1C2=CC=C(C=C2)O
• IUPAC Name: 4-cyclopropylphenol
• InChIKey: IGIWPHRUBXKMAR-UHFFFAOYSA-N
• INCHI: 1S/C9H10O/c10-9-5-3-8(4-6-9)7-1-2-7/h3-7,10H,1-2H2
• Isomere SMILES: C1CC1C2=CC=C(C=C2)O
• Molekulargewicht: 134.18
• Reaxy-Rn: 2325020
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2325020&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenols
      • Subclass 1-hydroxy-2-unsubstituted benzenoids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenols
• Subclass: 1-hydroxy-2-unsubstituted benzenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-hydroxy-2-unsubstituted benzenoids
• Alternative Parents: Benzene and substituted derivatives Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as 1-hydroxy-2-unsubstituted benzenoids. These are phenols that a unsubstituted at the 2-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

• Flammpunkt (°C): 119.8±11.0℃
• Siedepunkt (°C): 248.2±19.0℃ (760 Torr)
• Schmelzpunkt (°C): 57-58℃
• Molekulargewicht: 134.170 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 134.073 Da
• Monoisotopic Mass: 134.073 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 110.000
• 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