(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane

C8H16O2 — CID 59344944

IUPAC(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane
SMILESCCC[C@@H]1COC(C)(C)O1
InChIInChI=1S/C8H16O2/c1-4-5-7-6-9-8(2,3)10-7/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyGLGZEAHSFAJOPP-SSDOTTSWSA-N
MW144.21 g/mol
LogP1.94
Rot. Bonds2

About (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane

(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane (PubChem CID 59344944) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane.

Molecular Properties

Compound Name(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane
PubChem CID59344944
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane
SMILESCCC[C@@H]1COC(C)(C)O1
InChIInChI=1S/C8H16O2/c1-4-5-7-6-9-8(2,3)10-7/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyGLGZEAHSFAJOPP-SSDOTTSWSA-N
XLogP1.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-hexyl-2,2-dimethyl-1,3-dioxolane
CID 11275466
4-decyl-2,2-dimethyl-1,3-dioxolane
CID 71411741
4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-2,2-dimethyl-1,3-dioxolane
CID 58862633
CID 59269279
CID 59269279
3-propyl-1,4-dioxaspiro[4.4]nonane
CID 14592507
(2,2-dimethyl-1,3-dioxolan-4-yl)methanamine;hydrochloride
CID 21466688
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiohydroxylamine
CID 59058282
(4R)-4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyltellanylmethyl]-2,2-dimethyl-1,3-dioxolane
CID 132519104
(4S)-4-[(1-iodocyclopropyl)methyl]-2,2-dimethyl-1,3-dioxolane
CID 66849166
2-[2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethyl]-2,4,4,5,5-pentamethyl-1,3-dioxolane
CID 137496015
4-(2,2-dimethyl-1,3-dioxolan-4-yl)-N-ethylbutan-1-amine
CID 53230731
1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]pentan-2-ol
CID 57409905

Frequently Asked Questions

What is the IUPAC name of (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane?
The IUPAC name of (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane (CID 59344944) is (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane.
What is the SMILES notation for (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane?
The canonical SMILES for (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane is CCC[C@@H]1COC(C)(C)O1.
What is the InChIKey of (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane?
The InChIKey is GLGZEAHSFAJOPP-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H16O2/c1-4-5-7-6-9-8(2,3)10-7/h7H,4-6H2,1-3H3/t7-/m1/s1.
What are the key properties of (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane?
(4R)-2,2-dimethyl-4-propyl-1,3-dioxolane has a molecular weight of 144.21 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2,2-dimethyl-4-propyl-1,3-dioxolane is sourced from PubChem (CID 59344944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).