1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene

C192H396N2O4 — CID 161480394

About 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene

1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene (PubChem CID 161480394) has the molecular formula C192H396N2O4 and a molecular weight of 2797.29 g/mol. Its IUPAC name is 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene.

Molecular Properties

• Compound Name: 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene
• PubChem CID: 161480394
• Molecular Formula: C192H396N2O4
• Molecular Weight: 2797.29 g/mol
• Exact Mass: 2795.08
• IUPAC Name: 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene
• SMILES: CC(C)(C)/C=C/CCCC(C)(C)C.CC(C)(C)C/C=C/CC(C)(C)C.CC(C)(C)C/C=C/CCC(C)(C)C.CC(C)(C)C/C=C/CCC(C)(C)C.CC(C)(C)C/C=C/CCCC(C)(C)C.CC(C)(C)C/C=C\CCC(C)(C)C.CC(C)(C)CCC/C=C/C1(C(C)(C)C)CC1.CC(C)(C)CCCOCC(C)(C)C.CC(C)(C)CCCOCC(C)(C)C.CC(C)(C)CCOCCC(C)(C)C.CC(C)(C)COCCCC(C)(C)C(C)(C)C.CC(C)(C)NCCCCCC(C)(C)C(C)(C)C.CN(CCCCC(C)(C)C(C)(C)C)C(C)(C)C.C[C@@H](/C=C/CCCC(C)(C)C)C(C)(C)C
• InChI: InChI=1S/2C16H35N.C16H30.C15H32O.C15H30.C14H28.4C13H26.3C12H26O.C12H24/c1-14(2,3)16(7,8)12-10-11-13-17(9)15(4,5)6;1-14(2,3)16(7,8)12-10-9-11-13-17-15(4,5)6;1-14(2,3)10-8-7-9-11-16(12-13-16)15(4,5)6;1-13(2,3)12-16-11-9-10-15(7,8)14(4,5)6;1-13(15(5,6)7)11-9-8-10-12-14(2,3)4;1-13(2,3)11-9-7-8-10-12-14(4,5)6;4*1-12(2,3)10-8-7-9-11-13(4,5)6;1-11(2,3)7-9-13-10-8-12(4,5)6;2*1-11(2,3)8-7-9-13-10-12(4,5)6;1-11(2,3)9-7-8-10-12(4,5)6/h10-13H2,1-9H3;17H,9-13H2,1-8H3;9,11H,7-8,10,12-13H2,1-6H3;9-12H2,1-8H3;9,11,13H,8,10,12H2,1-7H3;7,9H,8,10-12H2,1-6H3;8,10H,7,9,11H2,1-6H3;3*7-8H,9-11H2,1-6H3;3*7-10H2,1-6H3;7-8H,9-10H2,1-6H3/b;;11-9+;;11-9+;9-7+;10-8+;2*8-7+;8-7-;;;;8-7+/t;;;;13-;;;;;;;;;/m....0........./s1
• InChIKey: WEGXSTQFGJOYHD-YLJPAVTBSA-N
• XLogP: 66.35
• TPSA: 52.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 54
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2797.29
LogP ≤ 5	66.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene?

The IUPAC name of 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene (CID 161480394) is 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene.

What is the SMILES notation for 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene?

The canonical SMILES for 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene is CC(C)(C)/C=C/CCCC(C)(C)C.CC(C)(C)C/C=C/CC(C)(C)C.CC(C)(C)C/C=C/CCC(C)(C)C.CC(C)(C)C/C=C/CCC(C)(C)C.CC(C)(C)C/C=C/CCCC(C)(C)C.CC(C)(C)C/C=C\CCC(C)(C)C.CC(C)(C)CCC/C=C/C1(C(C)(C)C)CC1.CC(C)(C)CCCOCC(C)(C)C.CC(C)(C)CCCOCC(C)(C)C.CC(C)(C)CCOCCC(C)(C)C.CC(C)(C)COCCCC(C)(C)C(C)(C)C.CC(C)(C)NCCCCCC(C)(C)C(C)(C)C.CN(CCCCC(C)(C)C(C)(C)C)C(C)(C)C.C[C@@H](/C=C/CCCC(C)(C)C)C(C)(C)C.

What is the InChIKey of 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene?

The InChIKey is WEGXSTQFGJOYHD-YLJPAVTBSA-N. The full InChI is InChI=1S/2C16H35N.C16H30.C15H32O.C15H30.C14H28.4C13H26.3C12H26O.C12H24/c1-14(2,3)16(7,8)12-10-11-13-17(9)15(4,5)6;1-14(2,3)16(7,8)12-10-9-11-13-17-15(4,5)6;1-14(2,3)10-8-7-9-11-16(12-13-16)15(4,5)6;1-13(2,3)12-16-11-9-10-15(7,8)14(4,5)6;1-13(15(5,6)7)11-9-8-10-12-14(2,3)4;1-13(2,3)11-9-7-8-10-12-14(4,5)6;4*1-12(2,3)10-8-7-9-11-13(4,5)6;1-11(2,3)7-9-13-10-8-12(4,5)6;2*1-11(2,3)8-7-9-13-10-12(4,5)6;1-11(2,3)9-7-8-10-12(4,5)6/h10-13H2,1-9H3;17H,9-13H2,1-8H3;9,11H,7-8,10,12-13H2,1-6H3;9-12H2,1-8H3;9,11,13H,8,10,12H2,1-7H3;7,9H,8,10-12H2,1-6H3;8,10H,7,9,11H2,1-6H3;3*7-8H,9-11H2,1-6H3;3*7-10H2,1-6H3;7-8H,9-10H2,1-6H3/b;;11-9+;;11-9+;9-7+;10-8+;2*8-7+;8-7-;;;;8-7+/t;;;;13-;;;;;;;;;/m....0........./s1.

What are the key properties of 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene?

1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene has a molecular weight of 2797.29 g/mol, XLogP of 66.35, 54 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-tert-butyl-1-[(E)-6,6-dimethylhept-1-enyl]cyclopropane;N-tert-butyl-N,5,5,6,6-pentamethylheptan-1-amine;N-tert-butyl-6,6,7,7-tetramethyloctan-1-amine;1-(3,3-dimethylbutoxy)-3,3-dimethylbutane;bis(1-(2,2-dimethylpropoxy)-4,4-dimethylpentane);1-(2,2-dimethylpropoxy)-4,4,5,5-tetramethylhexane;(E,3S)-2,2,3,9,9-pentamethyldec-4-ene;(E)-2,2,9,9-tetramethyldec-4-ene;(E)-2,2,8,8-tetramethylnon-3-ene;(Z)-2,2,8,8-tetramethylnon-4-ene;bis((E)-2,2,8,8-tetramethylnon-4-ene);(E)-2,2,7,7-tetramethyloct-4-ene is sourced from PubChem (CID 161480394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).