Name: Name:(1S,2S,3R,5S)-(+)-2,3-Pinanediol
Brand: AABLOCKS
SKU: AA0037KO
Rating: 90 (10 reviews)

Catalog No.: AA0037KO

18680-27-8 | (1S,2S,3R,5S)-(+)-2,3-Pinanediol

Pack Size： 1g

Purity： 95%

in stock

$12.00 $8.00

Pack Size： 5g

Purity： 95%

in stock

$13.00 $9.00

Pack Size： 25g

Purity： 95%

in stock

$35.00 $25.00

Pack Size： 500g

Purity： 98%

in stock

$662.00 $464.00

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Technical Information

Catalog Number: AA0037KO

Chemical Name: (1S,2S,3R,5S)-(+)-2,3-Pinanediol

CAS Number: 18680-27-8

Molecular Formula: C10H18O2

Molecular Weight: 170.2487

MDL Number: MFCD00077851

SMILES: O[C@@H]1C[C@@H]2C[C@H]([C@]1(C)O)C2(C)C

Properties

BP: 239.9°C (rough estimate)

Form: Solid

MP: 57-59 °C(lit.)

Refractive Index: 1.4494 (estimate)

Storage: Keep in dry area;Room Temperature;

Complexity: 212

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 4

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 2

Isotope Atom Count: 0

Rotatable Bond Count: 0

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.1

Upstream Synthesis Route

84110-40-7

18680-27-8

84110-34-9

[1]BioorganicandMedicinalChemistryLetters,2009,vol.19,#12,p.3220-3224

[2]Patent:CN103421033,2016,B,.Locationinpatent:Paragraph0047-0050

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[4]Patent:WO2005/21558,2005,A2,.Locationinpatent:Page/Pagecolumn52

[5]Patent:US2006/189806,2006,A1,.Locationinpatent:Page/Pagecolumn29

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[15]BioorganicandMedicinalChemistryLetters,2016,vol.26,#8,p.1958-1962

Downstream Synthesis Route

7785-70-8

18680-27-8

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18680-27-8

1845-25-6

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[2]CurrentPatentAssignee:CERENISTHERAPEUTICSHOLDING-US2014/275590,2014,A1Locationinpatent:Paragraph0256-0260

6336-45-4

18680-27-8

pinanediolvinylboronicester

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13061-96-6

18680-27-8

84110-38-3

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[2]Locationinpatent:schemeortableLi,Xianfeng;Zhang,Yong-Kang;Liu,Yang;Ding,CharlesZ.;Li,Qun;Zhou,Yasheen;Plattner,JacobJ.;Baker,StephenJ.;Qian,Xuelei;Fan,Dazhong;Liao,Liang;Ni,Zhi-Jie;White,GemmaV.;Mordaunt,JackieE.;Lazarides,LinosX.;Slater,MartinJ.;Jarvest,RichardL.;Thommes,Pia;Ellis,Malcolm;Edge,ColinM.;Hubbard,JuliaA.;Somers,Don;Rowland,Paul;Nassau,Pamela;McDowell,Bill;Skarzynski,TadeuszJ.;Kazmierski,WieslawM.;Grimes,RichardM.;Wright,LoisL.;Smith,GaryK.;Zou,Wuxin;Wright,Jon;Pennicott,LewisE.[BioorganicandMedicinalChemistryLetters,2010,vol.20,#12,p.3550-3556]

[3]Shreder,KevinR.;Wong,MelissaS.;Corral,Sergio;Yu,Zhizhou;Winn,DavidT.;Wu,Min;Hu,Yi;Nomanbhoy,Tyzoon;Alemayehu,Senaiet;Fuller,StacyR.;Rosenblum,JonathanS.;Kozarich,JohnW.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#19,p.4256-4260]

[4]Carmes,Laurence;Carreaux,Francois;Carboni,Bertrand[JournalofOrganicChemistry,2000,vol.65,#17,p.5403-5408]

80041-89-0

18680-27-8

90084-26-7

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