bis(but-3-en-1-yl)-1$l^{5},2$l^{5},3$l^{5},4$l^{5},5$l^{5},6$l^{5},7$l^{5},8$l^{5},9$l^{5},10$l^{5}-decaboranonadecacyclo[5.4.1.0^{1,3}.0^{1,4}.0^{2,6}.0^{2,7}.0^{2,12}.0^{3,5}.0^{3,6}.0^{4,9}.0^{4,11}.0^{5,8}.0^{5,9}.0^{6,8}.0^{7,10}.0^{8,10}.0^{9,11}.0^{10,12}.0^{11,12}]dodecane

• ChemBase ID: 64542
• Molecular Formular: C10H14B10
• Molecular Mass: 242.32816
• Monoisotopic Mass: 244.20260445
• SMILES: [B]1234[B]567[B]891[B]1%104[B]4%113[B]325[B]257[B]768[B]691[C]157([B]432[C]%10%1161CCC=C)CCC=C
• Canonical SMILES: C=CCC[C]1234[B]567[B]891[B]1%103[C]3%112([B]245[B]456[B]678[B]791[B]1%10%11[B]324[B]5671)CCC=C
• InChI: InChI=1S/C10H14B10/c1-3-5-7-9-10(8-6-4-2)11(9)13(9)14(9)12(9,10)16(10)15(10,11)17(11,13)19(13,14)18(12,14,16)20(15,16,17)19/h3-4H,1-2,5-8H2
• InChIKey: XKIWLNZUIIKSMK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(but-3-en-1-yl)-1$l^{5},2$l^{5},3$l^{5},4$l^{5},5$l^{5},6$l^{5},7$l^{5},8$l^{5},9$l^{5},10$l^{5}-decaboranonadecacyclo[5.4.1.0^{1,3}.0^{1,4}.0^{2,6}.0^{2,7}.0^{2,12}.0^{3,5}.0^{3,6}.0^{4,9}.0^{4,11}.0^{5,8}.0^{5,9}.0^{6,8}.0^{7,10}.0^{8,10}.0^{9,11}.0^{10,12}.0^{11,12}]dodecane
• IUPAC Traditional name: bis(but-3-en-1-yl)-1$l^{5},2$l^{5},3$l^{5},4$l^{5},5$l^{5},6$l^{5},7$l^{5},8$l^{5},9$l^{5},10$l^{5}-decaboranonadecacyclo[5.4.1.0^{1,3}.0^{1,4}.0^{2,6}.0^{2,7}.0^{2,12}.0^{3,5}.0^{3,6}.0^{4,9}.0^{4,11}.0^{5,8}.0^{5,9}.0^{6,8}.0^{7,10}.0^{8,10}.0^{9,11}.0^{10,12}.0^{11,12}]dodecane
• Synonyms: 1,2-Bis(3-butenyl)carborane

Database IDs

• CAS Number: 28109-72-0
• MDL Number: MFCD11114554
• PubChem SID: 162030281
• PubChem CID: 0

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• Molar Refractivity: 64.9282 cm^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 98%