(2R)-2-cyclopropyl-2-methoxyacetaldehyde

C6H10O2 — CID 124547234

IUPAC(2R)-2-cyclopropyl-2-methoxyacetaldehyde
SMILESCO[C@@H](C=O)C1CC1
InChIInChI=1S/C6H10O2/c1-8-6(4-7)5-2-3-5/h4-6H,2-3H2,1H3/t6-/m0/s1
InChIKeyBDDBRBBXVPPHJL-LURJTMIESA-N
MW114.14 g/mol
LogP0.61
Rot. Bonds3

About (2R)-2-cyclopropyl-2-methoxyacetaldehyde

(2R)-2-cyclopropyl-2-methoxyacetaldehyde (PubChem CID 124547234) has the molecular formula C6H10O2 and a molecular weight of 114.14 g/mol. Its IUPAC name is (2R)-2-cyclopropyl-2-methoxyacetaldehyde.

Molecular Properties

Compound Name(2R)-2-cyclopropyl-2-methoxyacetaldehyde
PubChem CID124547234
Molecular FormulaC6H10O2
Molecular Weight114.14 g/mol
Exact Mass114.07
IUPAC Name(2R)-2-cyclopropyl-2-methoxyacetaldehyde
SMILESCO[C@@H](C=O)C1CC1
InChIInChI=1S/C6H10O2/c1-8-6(4-7)5-2-3-5/h4-6H,2-3H2,1H3/t6-/m0/s1
InChIKeyBDDBRBBXVPPHJL-LURJTMIESA-N
XLogP0.61
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.14
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Methoxy-3-methylbutanal
CID 13792373
2-Methoxy-4-methylpentanal
CID 53764807
2-Cyclopropyl-2-methoxypropanal
CID 105427373
2-Cyclopropyl-2-ethoxyacetaldehyde
CID 130591097
2-(Cyclopropylmethoxy)propanal
CID 20220665
2-Methoxypentanal
CID 21900379
(2R)-2-Methoxypentanal
CID 57559006
2-Methoxy-3-methylpentanal
CID 58640306
2-Cyclopropyl-2-methoxyacetaldehyde
CID 83826166
2-Methoxy-2-(1-methoxycyclopropyl)acetaldehyde
CID 123701316
(1-Cyclopropyl-2-oxoethyl) acetate
CID 176124884
1-Cyclopropyl-1-methoxypropan-2-one
CID 83224626

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclopropyl-2-methoxyacetaldehyde?
The IUPAC name of (2R)-2-cyclopropyl-2-methoxyacetaldehyde (CID 124547234) is (2R)-2-cyclopropyl-2-methoxyacetaldehyde.
What is the SMILES notation for (2R)-2-cyclopropyl-2-methoxyacetaldehyde?
The canonical SMILES for (2R)-2-cyclopropyl-2-methoxyacetaldehyde is CO[C@@H](C=O)C1CC1.
What is the InChIKey of (2R)-2-cyclopropyl-2-methoxyacetaldehyde?
The InChIKey is BDDBRBBXVPPHJL-LURJTMIESA-N. The full InChI is InChI=1S/C6H10O2/c1-8-6(4-7)5-2-3-5/h4-6H,2-3H2,1H3/t6-/m0/s1.
What are the key properties of (2R)-2-cyclopropyl-2-methoxyacetaldehyde?
(2R)-2-cyclopropyl-2-methoxyacetaldehyde has a molecular weight of 114.14 g/mol, XLogP of 0.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclopropyl-2-methoxyacetaldehyde is sourced from PubChem (CID 124547234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).