Home Other Building Blocks 1,7-Octadiyne

1,7-Octadiyne

CAS No.:
871-84-1
Catalog Number:
AG003DRS
Molecular Formula:
C8H10
Molecular Weight:
106.1650
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Product Description
Catalog Number:
AG003DRS
Chemical Name:
1,7-Octadiyne
CAS Number:
871-84-1
Molecular Formula:
C8H10
Molecular Weight:
106.1650
MDL Number:
MFCD00008580
IUPAC Name:
octa-1,7-diyne
InChI:
InChI=1S/C8H10/c1-3-5-7-8-6-4-2/h1-2H,5-8H2
InChI Key:
DSOJWVLXZNRKCS-UHFFFAOYSA-N
SMILES:
C#CCCCCC#C
EC Number:
212-815-0
UNII:
PD2DJ8KFZ6
NSC Number:
35135
Properties
Complexity:
107  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
106.078g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
106.168g/mol
Monoisotopic Mass:
106.078g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Uranium(III)-mediated C-C-coupling of terminal alkynes: formation of dinuclear uranium(IV) vinyl complexes. Journal of the American Chemical Society 20120801
Azide-alkyne 'click' conjugation of 8-aza-7-deazaadenine-DNA: synthesis, duplex stability, and fluorogenic dye labeling. Bioconjugate chemistry 20100915
Remarkably variable reaction modes of frustrated Lewis pairs with non-conjugated terminal diacetylenes. Chemical communications (Cambridge, England) 20100528
Modification of DNA with octadiynyl side chains: synthesis, base pairing, and formation of fluorescent coumarin dye conjugates of four nucleobases by the alkyne--azide 'click' reaction. Bioconjugate chemistry 20080101
Azide-alkyne 'click' reaction performed on oligonucleotides with the universal nucleoside 7-octadiynyl-7-deaza-2'-deoxyinosine. Nucleic acids symposium series (2004) 20080101
Synthesis and unexpected reactivity of Si-H functionalized dithieno[3,2-b:2',3'-d]phospholes. Organic letters 20060202
C-H...pi interactions in the low-temperature crystal structures of alpha,omega-unsaturated linear hydrocarbons. Chemical communications (Cambridge, England) 20020821
Properties