(E)-1-bromo-3-methoxyprop-1-ene

C4H7BrO — CID 10888084

IUPAC(E)-1-bromo-3-methoxyprop-1-ene
SMILESCOC/C=C/Br
InChIInChI=1S/C4H7BrO/c1-6-4-2-3-5/h2-3H,4H2,1H3/b3-2+
InChIKeyMWXKJMNQXWHPFM-NSCUHMNNSA-N
MW151.00 g/mol
LogP1.54
Rot. Bonds2

About (E)-1-bromo-3-methoxyprop-1-ene

(E)-1-bromo-3-methoxyprop-1-ene (PubChem CID 10888084) has the molecular formula C4H7BrO and a molecular weight of 151.00 g/mol. Its IUPAC name is (E)-1-bromo-3-methoxyprop-1-ene.

Molecular Properties

Compound Name(E)-1-bromo-3-methoxyprop-1-ene
PubChem CID10888084
Molecular FormulaC4H7BrO
Molecular Weight151.00 g/mol
Exact Mass149.97
IUPAC Name(E)-1-bromo-3-methoxyprop-1-ene
SMILESCOC/C=C/Br
InChIInChI=1S/C4H7BrO/c1-6-4-2-3-5/h2-3H,4H2,1H3/b3-2+
InChIKeyMWXKJMNQXWHPFM-NSCUHMNNSA-N
XLogP1.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.00
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-1-bromo-3-methoxyprop-1-ene?
The IUPAC name of (E)-1-bromo-3-methoxyprop-1-ene (CID 10888084) is (E)-1-bromo-3-methoxyprop-1-ene.
What is the SMILES notation for (E)-1-bromo-3-methoxyprop-1-ene?
The canonical SMILES for (E)-1-bromo-3-methoxyprop-1-ene is COC/C=C/Br.
What is the InChIKey of (E)-1-bromo-3-methoxyprop-1-ene?
The InChIKey is MWXKJMNQXWHPFM-NSCUHMNNSA-N. The full InChI is InChI=1S/C4H7BrO/c1-6-4-2-3-5/h2-3H,4H2,1H3/b3-2+.
What are the key properties of (E)-1-bromo-3-methoxyprop-1-ene?
(E)-1-bromo-3-methoxyprop-1-ene has a molecular weight of 151.00 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-bromo-3-methoxyprop-1-ene is sourced from PubChem (CID 10888084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).