Borneol - ≥55% , CAS No.507-70-0

CAS: 507-70-0 Cat. No.: B109561 Fórmula: C₁₀H₁₈O Peso molecular: 154.25 Beilstein Registry Number: 6,73 Número CE: 208-080-0

GRAU & PUREZA ≥55%

Synonyms

Endo-2-camphanol|4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol|Bingpia|exo-2-Bornanol|BORNEOL, (L)|Endo-2-hydroxycamphane|Endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|DL-Borneol|DL-Isoborneol|Borneol|(+/-)-borneol|Borneol and Isoborneol|Borneol, exo-|DL-2-Bornanol|exo-1,7,7-Trimethylbicyclo(2.2.1)-2-heptanol|L(-)-Borneol|1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol|1,7,7-trimethyl-bicyclo[2.2.1]heptan-6-ol|1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol, exo- #|Borneo camphor|(2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol|Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-|exo-2-Camphanol|Bornyl alcohol|(+/-)-Isoborneol|1,7,7-Trimethylbicyclo(2.2.1)heptan-2-ol|Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, endo-(.+/-.)-|Isoborneol|endo-2-Bornanol

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Especificações

Sinónimos

Endo-2-camphanol | 4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol | Bingpia | exo-2-Bornanol | BORNEOL, (L) | Endo-2-hydroxycamphane | Endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | DL-Borneol | DL-Isoborneol | Borneol | (+/-)-borneol | Borneol and Isoborneol | Borneol, exo- | DL-2-Bornanol | exo-1,7,7-Trimethylbicyclo(2.2.1)-2-heptanol | L(-) Show more

Especificações e pureza

≥55%

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice,FedEx DG Service

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Tipo de ação

MODULATOR

Pureza

≥55%

Nomes e identificadores

Pubchem Sid

508817213

Sorrisos canónicos

CC1(C2CCC1(C(C2)O)C)C

IUPAC Name

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

InChIKey

DTGKSKDOIYIVQL-UHFFFAOYSA-N

INCHI

1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3

SMILES isoméricas

CC1(C2CCC1(C(C2)O)C)C

RTECS

ED7000000

Número UN

1312

Grupo de embalagem

III

Peso molecular

154.25

Beilstein

6,73

Reaxy-Rn

6052111

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6052111&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Bicyclic monoterpenoids
• Alternative Parents: Secondary alcohols Cyclic alcohols and derivatives Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Bicyclic monoterpenoid - Bornane monoterpenoid - Cyclic alcohol - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
• External Descriptors: a monoterpenol

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

Alvos associados (humanos)

UGT1A1 Tchem UDP-glucuronosyltransferase 1-1 (448 Activities)

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UGT1A6 Tbio UDP-glucuronosyltransferase 1-6 (221 Activities)

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UGT1A8 Tbio UDP-glucuronosyltransferase 1-8 (233 Activities)

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UGT1A9 Tbio UDP-glucuronosyltransferase 1-9 (343 Activities)

Discover Target: UGT1A9

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Alvos associados (não humanos)

Pyricularia grisea (1253 Activities)

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Pseudomonas aeruginosa (123386 Activities)

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Staphylococcus aureus (210822 Activities)

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Staphylococcus epidermidis (22802 Activities)

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Escherichia coli (133304 Activities)

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Phytophthora infestans (820 Activities)

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Cutibacterium acnes (887 Activities)

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Candida albicans (78123 Activities)

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Rattus norvegicus (775804 Activities)

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Puccinia recondita (281 Activities)

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Blumeria graminis (462 Activities)

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Tetranychus urticae (2600 Activities)

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Botrytis cinerea (4183 Activities)

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Trpa1 Transient receptor potential cation channel subfamily A member 1 (1003 Activities)

Discover Target: Trpa1

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Fusarium culmorum (260 Activities)

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Fusarium oxysporum f. sp. lycopersici (29 Activities)

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Leptinotarsa decemlineata (1161 Activities)

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Rhizoctonia solani (2251 Activities)

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Fusarium graminearum (1554 Activities)

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Corticium (78 Activities)

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Pythium (470 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Insoluble in water; Very soluble in Benzene,Ether,Alcohol; Soluble in Toluene,Acetone,Chloroform
• Ponto de ebulição (°C): 212°C
• Ponto de fusão (°C): 208°C
• Peso molecular: 154.250 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 154.136 Da
• Monoisotopic Mass: 154.136 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 185.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 3
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1