(E,3R)-6-chlorohex-5-en-3-ol

C6H11ClO — CID 13111033

IUPAC(E,3R)-6-chlorohex-5-en-3-ol
SMILESCC[C@@H](O)C/C=C/Cl
InChIInChI=1S/C6H11ClO/c1-2-6(8)4-3-5-7/h3,5-6,8H,2,4H2,1H3/b5-3+/t6-/m1/s1
InChIKeyKIZIJYKGXQPOSO-MXTDHUQFSA-N
MW134.61 g/mol
LogP1.90
Rot. Bonds3

About (E,3R)-6-chlorohex-5-en-3-ol

(E,3R)-6-chlorohex-5-en-3-ol (PubChem CID 13111033) has the molecular formula C6H11ClO and a molecular weight of 134.61 g/mol. Its IUPAC name is (E,3R)-6-chlorohex-5-en-3-ol.

Molecular Properties

Compound Name(E,3R)-6-chlorohex-5-en-3-ol
PubChem CID13111033
Molecular FormulaC6H11ClO
Molecular Weight134.61 g/mol
Exact Mass134.05
IUPAC Name(E,3R)-6-chlorohex-5-en-3-ol
SMILESCC[C@@H](O)C/C=C/Cl
InChIInChI=1S/C6H11ClO/c1-2-6(8)4-3-5-7/h3,5-6,8H,2,4H2,1H3/b5-3+/t6-/m1/s1
InChIKeyKIZIJYKGXQPOSO-MXTDHUQFSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.61
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E,3R)-6-chlorohex-5-en-3-ol?
The IUPAC name of (E,3R)-6-chlorohex-5-en-3-ol (CID 13111033) is (E,3R)-6-chlorohex-5-en-3-ol.
What is the SMILES notation for (E,3R)-6-chlorohex-5-en-3-ol?
The canonical SMILES for (E,3R)-6-chlorohex-5-en-3-ol is CC[C@@H](O)C/C=C/Cl.
What is the InChIKey of (E,3R)-6-chlorohex-5-en-3-ol?
The InChIKey is KIZIJYKGXQPOSO-MXTDHUQFSA-N. The full InChI is InChI=1S/C6H11ClO/c1-2-6(8)4-3-5-7/h3,5-6,8H,2,4H2,1H3/b5-3+/t6-/m1/s1.
What are the key properties of (E,3R)-6-chlorohex-5-en-3-ol?
(E,3R)-6-chlorohex-5-en-3-ol has a molecular weight of 134.61 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,3R)-6-chlorohex-5-en-3-ol is sourced from PubChem (CID 13111033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).