(E,2R)-5-chloropent-4-en-2-ol

C5H9ClO — CID 13111029

IUPAC(E,2R)-5-chloropent-4-en-2-ol
SMILESC[C@@H](O)C/C=C/Cl
InChIInChI=1S/C5H9ClO/c1-5(7)3-2-4-6/h2,4-5,7H,3H2,1H3/b4-2+/t5-/m1/s1
InChIKeyRVOOCNANFKAJPV-XWCPEMDWSA-N
MW120.58 g/mol
LogP1.51
Rot. Bonds2

About (E,2R)-5-chloropent-4-en-2-ol

(E,2R)-5-chloropent-4-en-2-ol (PubChem CID 13111029) has the molecular formula C5H9ClO and a molecular weight of 120.58 g/mol. Its IUPAC name is (E,2R)-5-chloropent-4-en-2-ol.

Molecular Properties

Compound Name(E,2R)-5-chloropent-4-en-2-ol
PubChem CID13111029
Molecular FormulaC5H9ClO
Molecular Weight120.58 g/mol
Exact Mass120.03
IUPAC Name(E,2R)-5-chloropent-4-en-2-ol
SMILESC[C@@H](O)C/C=C/Cl
InChIInChI=1S/C5H9ClO/c1-5(7)3-2-4-6/h2,4-5,7H,3H2,1H3/b4-2+/t5-/m1/s1
InChIKeyRVOOCNANFKAJPV-XWCPEMDWSA-N
XLogP1.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.58
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E,2R)-5-chloropent-4-en-2-ol?
The IUPAC name of (E,2R)-5-chloropent-4-en-2-ol (CID 13111029) is (E,2R)-5-chloropent-4-en-2-ol.
What is the SMILES notation for (E,2R)-5-chloropent-4-en-2-ol?
The canonical SMILES for (E,2R)-5-chloropent-4-en-2-ol is C[C@@H](O)C/C=C/Cl.
What is the InChIKey of (E,2R)-5-chloropent-4-en-2-ol?
The InChIKey is RVOOCNANFKAJPV-XWCPEMDWSA-N. The full InChI is InChI=1S/C5H9ClO/c1-5(7)3-2-4-6/h2,4-5,7H,3H2,1H3/b4-2+/t5-/m1/s1.
What are the key properties of (E,2R)-5-chloropent-4-en-2-ol?
(E,2R)-5-chloropent-4-en-2-ol has a molecular weight of 120.58 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2R)-5-chloropent-4-en-2-ol is sourced from PubChem (CID 13111029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).