Cas no 88426-33-9 (Buparvaquone)

Buparvaquone structure
Buparvaquone structure
Product Name:Buparvaquone
CAS No:88426-33-9
MF:C21H26O3
MW:326.429346561432
MDL:MFCD01712789
CID:61163
PubChem ID:329826000
Update Time:2024-10-26

Buparvaquone Chemical and Physical Properties

Names and Identifiers

    • Buparvaquone
    • 3-[(4-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione
    • 2-((4-tert-Butylcyclohexyl)methyl)-3-hydroxy-1,4-naphthochinon
    • Buparvacuona [Spanish]
    • Buparvaquonum [Latin]
    • Butalex
    • BW 720C
    • UNII-0354RT7LG4
    • 1,4-Naphthalenedione,2-[[4-(1,1-dimethylethyl)cyclohexyl]methyl]-3-
    • 2-[[4-(1,1-Dimethylethyl)cyclohexyl]methyl]-3-hydroxy-1,4-naphthalenedione
    • 2-[(4-tert-Butylcyclohexyl)methyl]-3-hydroxy-1,4-naphthoquinone
    • 2-((4-tert-Butylcyclohexyl)methyl)-3-hydroxy-1,4-naphthoquinone
    • 0354RT7LG4
    • MMV689480
    • 2-((4-(1,1-Dimethylethyl)cyclohexyl)methyl)-3-hydroxy-1,4-naphthalenedione
    • (RS,RS,RS,RS)-2-((4-ter
    • 2-[[4-(1,1-Dimethylethyl)cyclohexyl]methyl]-3-hydroxy-1,4-naphthalenedione (ACI)
    • SCHEMBL11030015
    • F17374
    • DTXSID4057849
    • 2-[[4-(1,1-Dimethylethyl)cyclohexyl]methyl]-3-hydroxy-1,4-naphthalenedione; Buparvaquone; Butalex
    • Buparvacuona
    • 1,4-Naphthalenedione, 2-[[4-(1,1-dimethylethyl)cyclohexyl]methyl]-3-hydroxy-
    • Tox21_113753
    • SR-05000022562
    • 2-((4-(tert-Butyl)cyclohexyl)methyl)-3-hydroxynaphthalene-1,4-dione
    • BDBM50504365
    • SR-05000022562-1
    • 2-[(4-tert-butylcyclohexyl)methyl]-3-hydroxynaphthalene-1,4-dione
    • 1,4-Naphthalenedione, 2-((4-(1,1-dimethylethyl)cyclohexyl)methyl)-3-hydroxy-
    • Q4998022
    • SCHEMBL9598809
    • PD086812
    • SCHEMBL21863689
    • Buparvaquonum
    • Buparvaquone, >=98% (HPLC)
    • s4971
    • CHEMBL292009
    • DTXCID5031638
    • CHEMBL3182074
    • NEGDTWQGGLJCTL-UHFFFAOYSA-N
    • BW-720C
    • DA-71814
    • Buparvaquone [INN:BAN]
    • Buparvaquone, VETRANAL(TM), analytical standard
    • CCG-267769
    • NCGC00253624-01
    • CAS-88426-33-9
    • 88426-33-9
    • BCP09338
    • (RS,RS,RS,RS)-2-((4-tert-Butylcyclohexyl)methyl)-3-hydroxy-1,4-naphthoquinone
    • BRN 5566006
    • Butalex;BW 720C;BW-720C;BW720C
    • NS00039266
    • AKOS030524058
    • Buparvaquona
    • BUPARVAQUONE [MI]
    • AKOS015899876
    • CS-3254
    • AS-12853
    • SCHEMBL22978
    • Q-200767
    • HY-17581
    • BUPARVAQUONE [INN]
    • EX-A977
    • MFCD01712789
    • BUPARVAQUONE [MART.]
    • MDL： MFCD01712789
    • Inchi： 1S/C21H26O3/c1-21(2,3)14-10-8-13(9-11-14)12-17-18(22)15-6-4-5-7-16(15)19(23)20(17)24/h4-7,13-14,24H,8-12H2,1-3H3
    • InChI Key： KLLIVCPQDTYMLC-UHFFFAOYSA-N
    • SMILES： O=C1C2C(=CC=CC=2)C(=O)C(CC2CCC(C(C)(C)C)CC2)=C1O
    • BRN： 5566006

Computed Properties

  • Exact Mass: 326.18800
  • Monoisotopic Mass: 326.188
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 3
  • Complexity: 544
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 54.4
  • XLogP3: 5.3

Experimental Properties

  • Color/Form: Yellow crystalline solid
  • Density: 1.158
  • Melting Point: 178-188°C
  • Boiling Point: 460.7°C at 760 mmHg
  • Flash Point: 246.536°C
  • Refractive Index: 1.574
  • Solubility: DMSO: soluble
  • PSA: 54.37000
  • LogP: 5.12030

Buparvaquone Security Information

  • Signal Word：None
  • Hazard Statement： H302-H315-H319-H335
  • Warning Statement： P273; P501
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • RTECS：QJ5766600
  • Toxicity：LD50 orally in rats: >2 g/kg (Hudson)
  • Storage Condition：Powder -20°C 3 years ? 4°C 2 years In solvent -80°C 6 months ? -20°C 1 month

Buparvaquone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
S e l l e c k ZHONG GUO
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 88426-33-9 99.9%
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 ￥794.67 2023-09-15
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 $50.0 2022-04-26
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 $70.0 2022-04-26
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 88426-33-9 99.82%
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 $90.0 2022-04-26
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 $ 75.00 2023-09-08
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B689555-10mg
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10mg
 $ 123.00 2023-09-08
TRC
B689555-25mg
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 $ 205.00 2023-09-08
TRC
B689555-50mg
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50mg
 $ 316.00 2023-04-18
TRC
B689555-100mg
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100mg
 $ 506.00 2023-04-18
TRC
B689555-250mg
Buparvaquone
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250mg
 $ 1108.00 2023-04-18

Buparvaquone Production Method

Production Method 1

Reaction Conditions
Reference
1.4-Naphthoquinones, their pharmaceutical and their veterinary formulations
, European Patent Organization, , ,

Production Method 2

Reaction Conditions
Reference
1.4-Naphthoquinones, their pharmaceutical and their veterinary formulations
, European Patent Organization, , ,

Buparvaquone Raw materials

Buparvaquone Preparation Products

Buparvaquone Related Literature

Related Categories

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