(Z)-5-bromonon-4-en-2-one

C9H15BrO — CID 101219247

IUPAC(Z)-5-bromonon-4-en-2-one
SMILESCCCC/C(Br)=C/CC(C)=O
InChIInChI=1S/C9H15BrO/c1-3-4-5-9(10)7-6-8(2)11/h7H,3-6H2,1-2H3/b9-7-
InChIKeyVMMOEXNTYIMHOC-CLFYSBASSA-N
MW219.12 g/mol
LogP3.43
Rot. Bonds5

About (Z)-5-bromonon-4-en-2-one

(Z)-5-bromonon-4-en-2-one (PubChem CID 101219247) has the molecular formula C9H15BrO and a molecular weight of 219.12 g/mol. Its IUPAC name is (Z)-5-bromonon-4-en-2-one.

Molecular Properties

Compound Name(Z)-5-bromonon-4-en-2-one
PubChem CID101219247
Molecular FormulaC9H15BrO
Molecular Weight219.12 g/mol
Exact Mass218.03
IUPAC Name(Z)-5-bromonon-4-en-2-one
SMILESCCCC/C(Br)=C/CC(C)=O
InChIInChI=1S/C9H15BrO/c1-3-4-5-9(10)7-6-8(2)11/h7H,3-6H2,1-2H3/b9-7-
InChIKeyVMMOEXNTYIMHOC-CLFYSBASSA-N
XLogP3.43
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.12
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (Z)-5-bromonon-4-en-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethene;hexan-2-one
CID 88765599
hexan-2-one;molecular nitrogen
CID 174442577
(Z)-6-bromo-5-butyldec-5-en-2-one
CID 101186070
(Z)-3-bromooct-2-ene
CID 13181431
(E)-4-bromooct-4-ene
CID 13093303
(Z)-6-bromo-7-hydroxyhept-5-en-2-one
CID 101333054
(5Z,9E)-6-bromotetracosa-5,9-dienoic acid
CID 6366721
6-bromotetracosa-5,9-dienoic acid
CID 3025843
(E)-7-bromododec-7-ene-2,6-dione
CID 166959864
CID 159436476
CID 159436476
N-(3-oxobutanoyl)pentanamide
CID 86030828
(E)-dec-4-en-2-one
CID 12955998

Frequently Asked Questions

What is the IUPAC name of (Z)-5-bromonon-4-en-2-one?
The IUPAC name of (Z)-5-bromonon-4-en-2-one (CID 101219247) is (Z)-5-bromonon-4-en-2-one.
What is the SMILES notation for (Z)-5-bromonon-4-en-2-one?
The canonical SMILES for (Z)-5-bromonon-4-en-2-one is CCCC/C(Br)=C/CC(C)=O.
What is the InChIKey of (Z)-5-bromonon-4-en-2-one?
The InChIKey is VMMOEXNTYIMHOC-CLFYSBASSA-N. The full InChI is InChI=1S/C9H15BrO/c1-3-4-5-9(10)7-6-8(2)11/h7H,3-6H2,1-2H3/b9-7-.
What are the key properties of (Z)-5-bromonon-4-en-2-one?
(Z)-5-bromonon-4-en-2-one has a molecular weight of 219.12 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-bromonon-4-en-2-one is sourced from PubChem (CID 101219247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).