Name: Name:3-Heptyn-1-ol
Brand: AABLOCKS
SKU: AA001LCI
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA001LCI

Chemical Name: 3-Heptyn-1-ol

CAS Number: 14916-79-1

Molecular Formula: C7H12O

Molecular Weight: 112.1696

MDL Number: MFCD00039551

SMILES: CCCC#CCCO

Properties

BP: 80-82 °C15 mm Hg

Form: Liquid

MP: -20.62°C (estimate)

Refractive Index: n20/D 1.456

Storage: 2-8℃;

Complexity: 93.4

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 8

Hydrogen Bond Acceptor Count: 1

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.6

Downstream Synthesis Route

14916-79-1

63478-76-2

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14916-79-1

87462-63-3

[1]Knapp,F.F.;Srivastava,P.C.;Callahan,A.P.;Cunningham,E.B.;Kabalka,G.W.;Sastry,K.A.R.[JournalofMedicinalChemistry,1984,vol.27,#1,p.57-63]

[2]Fang,Fang;Vogel,Megan;Hines,JenniferV.;Bergmeier,StephenC.[OrganicandBiomolecularChemistry,2012,vol.10,#15,p.3080-3091]

14916-79-1

40642-40-8

[1]Odinokov,V.N.;Ishmuratov,G.Yu.;Balezina,G.G.;Tolstikov,G.A.[ChemistryofNaturalCompounds,1985,vol.21,#3,p.372-374][KhimiyaPrirodnykhSoedinenii,1985,vol.21,#3,p.398-400]

14916-79-1

28079-04-1

[1]Odinokov,V.N.;Ishmuratov,G.Yu.;Balezina,G.G.;Tolstikov,G.A.[ChemistryofNaturalCompounds,1985,vol.21,#3,p.372-374][KhimiyaPrirodnykhSoedinenii,1985,vol.21,#3,p.398-400]

14916-79-1

38363-29-0

[1]Odinokov,V.N.;Ishmuratov,G.Yu.;Balezina,G.G.;Tolstikov,G.A.[ChemistryofNaturalCompounds,1985,vol.21,#3,p.372-374][KhimiyaPrirodnykhSoedinenii,1985,vol.21,#3,p.398-400]

14916-79-1 | 3-Heptyn-1-ol