1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane

C143H284 — CID 21338514

IUPAC1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane
SMILESCC(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)CC(C)(C)C1CC1C1(C(C)C)CC1
InChIInChI=1S/C143H284/c1-75(2)78(6)80(8)82(10)84(12)86(14)88(16)90(18)92(20)94(22)96(24)98(26)100(28)102(30)103(31)104(32)105(33)106(34)107(35)108(36)109(37)110(38)111(39)112(40)114(42)116(44)118(46)120(48)122(50)124(52)126(54)128(56)130(58)132(60)134(62)136(64)138(66)142(69,70)137(65)135(63)133(61)131(59)129(57)127(55)125(53)123(51)121(49)119(47)117(45)115(43)113(41)101(29)99(27)97(25)95(23)93(21)91(19)89(17)87(15)85(13)83(11)81(9)79(7)77(5)74-141(67,68)139-73-140(139)143(71-72-143)76(3)4/h75-140H,71-74H2,1-70H3
InChIKeyZYNRAFUWMBCUNO-UHFFFAOYSA-N
MW2003.84 g/mol
LogP45.60
Rot. Bonds68

About 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane

1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane (PubChem CID 21338514) has the molecular formula C143H284 and a molecular weight of 2003.84 g/mol. Its IUPAC name is 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane.

Molecular Properties

Compound Name1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane
PubChem CID21338514
Molecular FormulaC143H284
Molecular Weight2003.84 g/mol
Exact Mass2002.22
IUPAC Name1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane
SMILESCC(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)CC(C)(C)C1CC1C1(C(C)C)CC1
InChIInChI=1S/C143H284/c1-75(2)78(6)80(8)82(10)84(12)86(14)88(16)90(18)92(20)94(22)96(24)98(26)100(28)102(30)103(31)104(32)105(33)106(34)107(35)108(36)109(37)110(38)111(39)112(40)114(42)116(44)118(46)120(48)122(50)124(52)126(54)128(56)130(58)132(60)134(62)136(64)138(66)142(69,70)137(65)135(63)133(61)131(59)129(57)127(55)125(53)123(51)121(49)119(47)117(45)115(43)113(41)101(29)99(27)97(25)95(23)93(21)91(19)89(17)87(15)85(13)83(11)81(9)79(7)77(5)74-141(67,68)139-73-140(139)143(71-72-143)76(3)4/h75-140H,71-74H2,1-70H3
InChIKeyZYNRAFUWMBCUNO-UHFFFAOYSA-N
XLogP45.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds68
Heavy Atoms143
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002003.84
LogP ≤ 545.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane with MolForge

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Related Compounds

1-Butylspiropentane
CID 22566
1,2,3,4-Tetrakis(1,1-dimethylethyl)tricyclo(1.1.0.02,4)butane
CID 144194
1'-Methyl-1,1':2',1''-tercyclopropane
CID 519050
1,1'-Bicyclopropyl, 2,2,2',2'-tetramethyl-
CID 563701
Quatercyclopropane
CID 46850497
Hexacyclopropylethane
CID 141327
Pentacyclo[9.1.0.0(2,4).0(5,7).0(8,10)]dodecane, 3,3,6,6,9,9,12,12-octamethyl-, anti,anti,anti-
CID 534943
Pentacyclo[9.1.0.0(2,4).0(5,7).0(8,10)]dodecane, 3,3,6,6,9,9,12,12-octaethyl-
CID 543650
1,2',2'-Trimethyl-1,1'-bi(cyclopropane)
CID 13115327
2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12-Icosamethyltridecane
CID 20658770
1-Cyclopropylmethyl-1,2-diethylcyclopropane
CID 91612623
Octamethyldotriacontane
CID 129773615

Frequently Asked Questions

What is the IUPAC name of 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane?
The IUPAC name of 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane (CID 21338514) is 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane.
What is the SMILES notation for 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane?
The canonical SMILES for 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane is CC(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)C(C)CC(C)(C)C1CC1C1(C(C)C)CC1.
What is the InChIKey of 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane?
The InChIKey is ZYNRAFUWMBCUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C143H284/c1-75(2)78(6)80(8)82(10)84(12)86(14)88(16)90(18)92(20)94(22)96(24)98(26)100(28)102(30)103(31)104(32)105(33)106(34)107(35)108(36)109(37)110(38)111(39)112(40)114(42)116(44)118(46)120(48)122(50)124(52)126(54)128(56)130(58)132(60)134(62)136(64)138(66)142(69,70)137(65)135(63)133(61)131(59)129(57)127(55)125(53)123(51)121(49)119(47)117(45)115(43)113(41)101(29)99(27)97(25)95(23)93(21)91(19)89(17)87(15)85(13)83(11)81(9)79(7)77(5)74-141(67,68)139-73-140(139)143(71-72-143)76(3)4/h75-140H,71-74H2,1-70H3.
What are the key properties of 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane?
1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane has a molecular weight of 2003.84 g/mol, XLogP of 45.60, 68 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67-hexahexacontamethyloctahexacontan-2-yl)-2-(1-propan-2-ylcyclopropyl)cyclopropane is sourced from PubChem (CID 21338514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).