(2R)-2-(1,3-dioxolan-2-yl)propanal

C6H10O3 — CID 71762163

IUPAC(2R)-2-(1,3-dioxolan-2-yl)propanal
SMILESC[C@H](C=O)C1OCCO1
InChIInChI=1S/C6H10O3/c1-5(4-7)6-8-2-3-9-6/h4-6H,2-3H2,1H3/t5-/m1/s1
InChIKeyLWEGDORAJNSHHS-RXMQYKEDSA-N
MW130.14 g/mol
LogP0.19
Rot. Bonds2

About (2R)-2-(1,3-dioxolan-2-yl)propanal

(2R)-2-(1,3-dioxolan-2-yl)propanal (PubChem CID 71762163) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is (2R)-2-(1,3-dioxolan-2-yl)propanal.

Molecular Properties

Compound Name(2R)-2-(1,3-dioxolan-2-yl)propanal
PubChem CID71762163
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name(2R)-2-(1,3-dioxolan-2-yl)propanal
SMILESC[C@H](C=O)C1OCCO1
InChIInChI=1S/C6H10O3/c1-5(4-7)6-8-2-3-9-6/h4-6H,2-3H2,1H3/t5-/m1/s1
InChIKeyLWEGDORAJNSHHS-RXMQYKEDSA-N
XLogP0.19
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1,3-dioxolan-2-yl)propanal?
The IUPAC name of (2R)-2-(1,3-dioxolan-2-yl)propanal (CID 71762163) is (2R)-2-(1,3-dioxolan-2-yl)propanal.
What is the SMILES notation for (2R)-2-(1,3-dioxolan-2-yl)propanal?
The canonical SMILES for (2R)-2-(1,3-dioxolan-2-yl)propanal is C[C@H](C=O)C1OCCO1.
What is the InChIKey of (2R)-2-(1,3-dioxolan-2-yl)propanal?
The InChIKey is LWEGDORAJNSHHS-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H10O3/c1-5(4-7)6-8-2-3-9-6/h4-6H,2-3H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-2-(1,3-dioxolan-2-yl)propanal?
(2R)-2-(1,3-dioxolan-2-yl)propanal has a molecular weight of 130.14 g/mol, XLogP of 0.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1,3-dioxolan-2-yl)propanal is sourced from PubChem (CID 71762163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).