(Z)-1,2-dibromohex-1-en-3-ol

C6H10Br2O — CID 5376108

IUPAC(Z)-1,2-dibromohex-1-en-3-ol
SMILESCCCC(O)/C(Br)=C/Br
InChIInChI=1S/C6H10Br2O/c1-2-3-6(9)5(8)4-7/h4,6,9H,2-3H2,1H3/b5-4-
InChIKeyAHKXIIONADKWCU-PLNGDYQASA-N
MW257.95 g/mol
LogP2.78
Rot. Bonds3

About (Z)-1,2-dibromohex-1-en-3-ol

(Z)-1,2-dibromohex-1-en-3-ol (PubChem CID 5376108) has the molecular formula C6H10Br2O and a molecular weight of 257.95 g/mol. Its IUPAC name is (Z)-1,2-dibromohex-1-en-3-ol.

Molecular Properties

Compound Name(Z)-1,2-dibromohex-1-en-3-ol
PubChem CID5376108
Molecular FormulaC6H10Br2O
Molecular Weight257.95 g/mol
Exact Mass255.91
IUPAC Name(Z)-1,2-dibromohex-1-en-3-ol
SMILESCCCC(O)/C(Br)=C/Br
InChIInChI=1S/C6H10Br2O/c1-2-3-6(9)5(8)4-7/h4,6,9H,2-3H2,1H3/b5-4-
InChIKeyAHKXIIONADKWCU-PLNGDYQASA-N
XLogP2.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.95
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,2-dibromohex-1-en-3-ol?
The IUPAC name of (Z)-1,2-dibromohex-1-en-3-ol (CID 5376108) is (Z)-1,2-dibromohex-1-en-3-ol.
What is the SMILES notation for (Z)-1,2-dibromohex-1-en-3-ol?
The canonical SMILES for (Z)-1,2-dibromohex-1-en-3-ol is CCCC(O)/C(Br)=C/Br.
What is the InChIKey of (Z)-1,2-dibromohex-1-en-3-ol?
The InChIKey is AHKXIIONADKWCU-PLNGDYQASA-N. The full InChI is InChI=1S/C6H10Br2O/c1-2-3-6(9)5(8)4-7/h4,6,9H,2-3H2,1H3/b5-4-.
What are the key properties of (Z)-1,2-dibromohex-1-en-3-ol?
(Z)-1,2-dibromohex-1-en-3-ol has a molecular weight of 257.95 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,2-dibromohex-1-en-3-ol is sourced from PubChem (CID 5376108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).