Dibenzosuberol - ≥98% , CAS No.1210-34-0

CAS: 1210-34-0 Cat. No.: D348797 Formule: C₁₅H₁₄O Poids moléculaire: 210.27 Beilstein Registry Number: 520430 Numéro CE: 214-911-8

GRADE & PURITY ≥98%

Synonyms

10,11-Dihydro-5Hdibenzo[a,d]cicloheptadien-5-ol | 5H-DIBENZO(a,d)CYCLOHEPTEN-5-OL, 10,11-DIHYDRO- | J-004429 | AMITRIPTYLINE HYDROCHLORIDE IMPURITY G [EP IMPURITY] | Dibenzosuberol;5-Hydroxy-10,11-dihydro-5H-dibenzo[a,d][7]annulene | 6,11-dihydro-5H-diben

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Synonymes

10,11-Dihydro-5Hdibenzo[a,d]cicloheptadien-5-ol | 5H-DIBENZO(a,d)CYCLOHEPTEN-5-OL, 10,11-DIHYDRO- | J-004429 | AMITRIPTYLINE HYDROCHLORIDE IMPURITY G [EP IMPURITY] | Dibenzosuberol;5-Hydroxy-10,11-dihydro-5H-dibenzo[a,d][7]annulene | 6,11-dihydro-5H-diben

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at -20°C,Argon charged

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Pubchem Sid

504752575

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752575

Sourires canoniques

C1CC2=CC=CC=C2C(C3=CC=CC=C31)O

IUPAC Name

tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ol

InChIKey

POAVRNPUPPJLKZ-UHFFFAOYSA-N

INCHI

1S/C15H14O/c16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2

Isomères SMILES

C1CC2=CC=CC=C2C(C3=CC=CC=C31)O

RTECS

HP1100000

Poids moléculaire

210.27

Beilstein

520430

Reaxy-Rn

520430

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=520430&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Dibenzocycloheptenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Dibenzocycloheptenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Dibenzocycloheptenes
• Alternative Parents: Secondary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Dibenzocycloheptene - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as dibenzocycloheptenes. These are compounds containing a dibenzocycloheptene moiety, which consists of two benzene rings connected by a cycloheptene ring.
• 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

Propriétés chimiques et physiques

• Solubilité: Soluble in water (partly).Chloroform (Slightly), Ethyl Acetate (Slightly)
• Sensibilité: Hygroscopic
• Indice de réfraction: n20D1.63 (Predicted)
• Point d'ébullition (°C): 166-169° C at 1 mmHg
• Point de fusion (°C): 90-96ºC
• Poids moléculaire: 210.270 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 210.104 Da
• Monoisotopic Mass: 210.104 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 214.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1210-34-0, the molecular formula is C15H14O, and the molecular weight is 210.27 g/mol. InChIKey POAVRNPUPPJLKZ-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.