(2R)-2-methanidyl-1-propoxypropane;bis(yttrium)

C7H14OY2-2 — CID 171424381

IUPAC(2R)-2-methanidyl-1-propoxypropane;bis(yttrium)
SMILES[CH2-][C@H](C)COC[CH-]C.[Y].[Y]
InChIInChI=1S/C7H14O.2Y/c1-4-5-8-6-7(2)3;;/h4,7H,2,5-6H2,1,3H3;;/q-2;;/t7-;;/m1../s1
InChIKeyQEMCSSOLYMCCIR-XCUBXKJBSA-N
MW292.00 g/mol
LogP1.69
Rot. Bonds4

About (2R)-2-methanidyl-1-propoxypropane;bis(yttrium)

(2R)-2-methanidyl-1-propoxypropane;bis(yttrium) (PubChem CID 171424381) has the molecular formula C7H14OY2-2 and a molecular weight of 292.00 g/mol. Its IUPAC name is (2R)-2-methanidyl-1-propoxypropane;bis(yttrium).

Molecular Properties

Compound Name(2R)-2-methanidyl-1-propoxypropane;bis(yttrium)
PubChem CID171424381
Molecular FormulaC7H14OY2-2
Molecular Weight292.00 g/mol
Exact Mass291.92
IUPAC Name(2R)-2-methanidyl-1-propoxypropane;bis(yttrium)
SMILES[CH2-][C@H](C)COC[CH-]C.[Y].[Y]
InChIInChI=1S/C7H14O.2Y/c1-4-5-8-6-7(2)3;;/h4,7H,2,5-6H2,1,3H3;;/q-2;;/t7-;;/m1../s1
InChIKeyQEMCSSOLYMCCIR-XCUBXKJBSA-N
XLogP1.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.00
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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butan-1-ol;methane;4-methanidyl-1,7-bis(2-methylpropoxy)heptane;yttrium
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CID 147587946
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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methanidyl-1-propoxypropane;bis(yttrium)?
The IUPAC name of (2R)-2-methanidyl-1-propoxypropane;bis(yttrium) (CID 171424381) is (2R)-2-methanidyl-1-propoxypropane;bis(yttrium).
What is the SMILES notation for (2R)-2-methanidyl-1-propoxypropane;bis(yttrium)?
The canonical SMILES for (2R)-2-methanidyl-1-propoxypropane;bis(yttrium) is [CH2-][C@H](C)COC[CH-]C.[Y].[Y].
What is the InChIKey of (2R)-2-methanidyl-1-propoxypropane;bis(yttrium)?
The InChIKey is QEMCSSOLYMCCIR-XCUBXKJBSA-N. The full InChI is InChI=1S/C7H14O.2Y/c1-4-5-8-6-7(2)3;;/h4,7H,2,5-6H2,1,3H3;;/q-2;;/t7-;;/m1../s1.
What are the key properties of (2R)-2-methanidyl-1-propoxypropane;bis(yttrium)?
(2R)-2-methanidyl-1-propoxypropane;bis(yttrium) has a molecular weight of 292.00 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methanidyl-1-propoxypropane;bis(yttrium) is sourced from PubChem (CID 171424381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).