(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol

C6H8Br2O — CID 10777426

IUPAC(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol
SMILESC=C(Br)C/C(=C/Br)CO
InChIInChI=1S/C6H8Br2O/c1-5(8)2-6(3-7)4-9/h3,9H,1-2,4H2/b6-3-
InChIKeyUGNNWMGNAXXAND-UTCJRWHESA-N
MW255.94 g/mol
LogP2.56
Rot. Bonds3

About (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol

(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol (PubChem CID 10777426) has the molecular formula C6H8Br2O and a molecular weight of 255.94 g/mol. Its IUPAC name is (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol.

Molecular Properties

Compound Name(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol
PubChem CID10777426
Molecular FormulaC6H8Br2O
Molecular Weight255.94 g/mol
Exact Mass253.89
IUPAC Name(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol
SMILESC=C(Br)C/C(=C/Br)CO
InChIInChI=1S/C6H8Br2O/c1-5(8)2-6(3-7)4-9/h3,9H,1-2,4H2/b6-3-
InChIKeyUGNNWMGNAXXAND-UTCJRWHESA-N
XLogP2.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.94
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol?
The IUPAC name of (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol (CID 10777426) is (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol.
What is the SMILES notation for (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol?
The canonical SMILES for (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol is C=C(Br)C/C(=C/Br)CO.
What is the InChIKey of (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol?
The InChIKey is UGNNWMGNAXXAND-UTCJRWHESA-N. The full InChI is InChI=1S/C6H8Br2O/c1-5(8)2-6(3-7)4-9/h3,9H,1-2,4H2/b6-3-.
What are the key properties of (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol?
(2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol has a molecular weight of 255.94 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-4-bromo-2-(bromomethylidene)pent-4-en-1-ol is sourced from PubChem (CID 10777426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).