(3Z)-2-methylpenta-1,3-diene;yttrium

C6H8Y-2 — CID 58172805

IUPAC(3Z)-2-methylpenta-1,3-diene;yttrium
SMILES[H]/[C-]=C(C)/C=C\[CH2-].[Y]
InChIInChI=1S/C6H8.Y/c1-4-5-6(2)3;/h2,4-5H,1H2,3H3;/q-2;/b5-4-;
InChIKeyZZCICLVXTTVEJL-MKWAYWHRSA-N
MW169.04 g/mol
LogP1.75
Rot. Bonds1

About (3Z)-2-methylpenta-1,3-diene;yttrium

(3Z)-2-methylpenta-1,3-diene;yttrium (PubChem CID 58172805) has the molecular formula C6H8Y-2 and a molecular weight of 169.04 g/mol. Its IUPAC name is (3Z)-2-methylpenta-1,3-diene;yttrium.

Molecular Properties

Compound Name(3Z)-2-methylpenta-1,3-diene;yttrium
PubChem CID58172805
Molecular FormulaC6H8Y-2
Molecular Weight169.04 g/mol
Exact Mass168.97
IUPAC Name(3Z)-2-methylpenta-1,3-diene;yttrium
SMILES[H]/[C-]=C(C)/C=C\[CH2-].[Y]
InChIInChI=1S/C6H8.Y/c1-4-5-6(2)3;/h2,4-5H,1H2,3H3;/q-2;/b5-4-;
InChIKeyZZCICLVXTTVEJL-MKWAYWHRSA-N
XLogP1.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.04
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

bis(2-methylbuta-1,3-diene);nickel(2+)
CID 173162838
2,3-dimethylbuta-1,3-diene;pentakis(yttrium)
CID 58460586
2,4-dimethylpenta-1,3-diene;nitroxyl anion;tungsten
CID 140525116
carbanide;cobalt(3+);2-methanidylprop-1-ene
CID 59163874
cyclopenta-1,3-diene;2-methylpenta-1,3-diene;titanium(2+)
CID 173337087
(3Z)-penta-1,3-diene;yttrium
CID 58962895
trimethyl(prop-1-en-2-yl)silane;yttrium
CID 59910689
aluminum;lithium;butane;carbanide;1,3,3-trimethyl-2-[(1E)-3-methylbuta-1,3-dienyl]cyclohexene
CID 11823059
chromium(2+);2,4-dimethylpenta-1,3-diene;1,2,3,4,5-pentamethylcyclopenta-1,3-diene
CID 131717665
5-methanidylidene-2,6-dimethylhept-3-ene;yttrium
CID 58430468
ethane;4-methanidylidene-5-methylhex-2-en-1-one;3-methanidyl-4-methylpent-2-en-1-one;bis(yttrium)
CID 158108291
propan-2-ylideneazanide;yttrium
CID 59954797

Frequently Asked Questions

What is the IUPAC name of (3Z)-2-methylpenta-1,3-diene;yttrium?
The IUPAC name of (3Z)-2-methylpenta-1,3-diene;yttrium (CID 58172805) is (3Z)-2-methylpenta-1,3-diene;yttrium.
What is the SMILES notation for (3Z)-2-methylpenta-1,3-diene;yttrium?
The canonical SMILES for (3Z)-2-methylpenta-1,3-diene;yttrium is [H]/[C-]=C(C)/C=C\[CH2-].[Y].
What is the InChIKey of (3Z)-2-methylpenta-1,3-diene;yttrium?
The InChIKey is ZZCICLVXTTVEJL-MKWAYWHRSA-N. The full InChI is InChI=1S/C6H8.Y/c1-4-5-6(2)3;/h2,4-5H,1H2,3H3;/q-2;/b5-4-;.
What are the key properties of (3Z)-2-methylpenta-1,3-diene;yttrium?
(3Z)-2-methylpenta-1,3-diene;yttrium has a molecular weight of 169.04 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-2-methylpenta-1,3-diene;yttrium is sourced from PubChem (CID 58172805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).