methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene

C34H68 — CID 159350576

IUPACmethane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene
SMILESC.C.C/C(=C(\C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C
InChIInChI=1S/C32H60.2CH4/c1-21(29(13,14)23(3)25(5)31(17,18)27(7,8)9)22(2)30(15,16)24(4)26(6)32(19,20)28(10,11)12;;/h1-20H3;2*1H4/b22-21-,25-23-,26-24-;;
InChIKeyLHGUJWCYKSKDPR-PTRHJFLJSA-N
MW476.92 g/mol
LogP12.46
Rot. Bonds6

About methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene

methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene (PubChem CID 159350576) has the molecular formula C34H68 and a molecular weight of 476.92 g/mol. Its IUPAC name is methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene.

Molecular Properties

Compound Namemethane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene
PubChem CID159350576
Molecular FormulaC34H68
Molecular Weight476.92 g/mol
Exact Mass476.53
IUPAC Namemethane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene
SMILESC.C.C/C(=C(\C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C
InChIInChI=1S/C32H60.2CH4/c1-21(29(13,14)23(3)25(5)31(17,18)27(7,8)9)22(2)30(15,16)24(4)26(6)32(19,20)28(10,11)12;;/h1-20H3;2*1H4/b22-21-,25-23-,26-24-;;
InChIKeyLHGUJWCYKSKDPR-PTRHJFLJSA-N
XLogP12.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.92
LogP ≤ 512.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene with MolForge

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Related Compounds

(Z)-2,2,3,3,4,5,6,6,7,7-decamethyloct-4-ene;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene;(4Z,7Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,10-tetradecamethylundeca-4,7-diene
CID 160906844
(Z)-N,N,3,4,4,5,5-heptamethylhex-2-en-2-amine
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3,4,4,5,5-pentamethylhex-2-ene-1,1,1,2-tetramine
CID 171483557
(Z)-N,3,4,5,5,6,6-heptamethylhept-3-en-2-imine
CID 58299412
3,3,4,4-tetramethylpent-1-en-2-ol
CID 89381848
methane;2-methylpropan-2-ol
CID 157161859
lithium 2-methylpropan-2-ol
CID 21120036
3,3-dimethylbutan-2-one;2,2-dimethylpropanoic acid;methane
CID 159044795
lithium (Z)-3,4,4-trimethylpent-2-en-2-olate
CID 134874168
2,2,3,3-tetramethyl-N,N-di(propan-2-yl)butanamide
CID 58799213
(Z)-3,3,4,5,6,6,7-heptamethyloct-4-en-2-one
CID 166508440
carbanide;2-methylpropan-2-ol;tungsten
CID 58800760

Frequently Asked Questions

What is the IUPAC name of methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene?
The IUPAC name of methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene (CID 159350576) is methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene.
What is the SMILES notation for methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene?
The canonical SMILES for methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene is C.C.C/C(=C(\C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C)C(C)(C)/C(C)=C(/C)C(C)(C)C(C)(C)C.
What is the InChIKey of methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene?
The InChIKey is LHGUJWCYKSKDPR-PTRHJFLJSA-N. The full InChI is InChI=1S/C32H60.2CH4/c1-21(29(13,14)23(3)25(5)31(17,18)27(7,8)9)22(2)30(15,16)24(4)26(6)32(19,20)28(10,11)12;;/h1-20H3;2*1H4/b22-21-,25-23-,26-24-;;.
What are the key properties of methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene?
methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene has a molecular weight of 476.92 g/mol, XLogP of 12.46, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;(4Z,7Z,10Z)-2,2,3,3,4,5,6,6,7,8,9,9,10,11,12,12,13,13-octadecamethyltetradeca-4,7,10-triene is sourced from PubChem (CID 159350576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).