2-(5-bromopent-4-enyl)cyclopropan-1-ol

C8H13BrO — CID 123911328

IUPAC2-(5-bromopent-4-enyl)cyclopropan-1-ol
SMILESOC1CC1CCCC=CBr
InChIInChI=1S/C8H13BrO/c9-5-3-1-2-4-7-6-8(7)10/h3,5,7-8,10H,1-2,4,6H2
InChIKeyTZXVUMYHBLBHJY-UHFFFAOYSA-N
MW205.09 g/mol
LogP2.45
Rot. Bonds4

About 2-(5-bromopent-4-enyl)cyclopropan-1-ol

2-(5-bromopent-4-enyl)cyclopropan-1-ol (PubChem CID 123911328) has the molecular formula C8H13BrO and a molecular weight of 205.09 g/mol. Its IUPAC name is 2-(5-bromopent-4-enyl)cyclopropan-1-ol.

Molecular Properties

Compound Name2-(5-bromopent-4-enyl)cyclopropan-1-ol
PubChem CID123911328
Molecular FormulaC8H13BrO
Molecular Weight205.09 g/mol
Exact Mass204.01
IUPAC Name2-(5-bromopent-4-enyl)cyclopropan-1-ol
SMILESOC1CC1CCCC=CBr
InChIInChI=1S/C8H13BrO/c9-5-3-1-2-4-7-6-8(7)10/h3,5,7-8,10H,1-2,4,6H2
InChIKeyTZXVUMYHBLBHJY-UHFFFAOYSA-N
XLogP2.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.09
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

cis-(1R,2R)-2-butylcyclopropan-1-ol
CID 14453673
trans-(1R,2S)-2-(3-chloropropyl)cyclopropan-1-ol
CID 129391118
cis-(1S,2S)-2-butylcyclopropan-1-ol
CID 14453674
2-hex-3-enylcyclopropan-1-ol
CID 123588538
(2S)-2-[(Z)-6-aminohex-4-enyl]cyclopropan-1-amine
CID 156542352
(E)-1-bromohex-1-ene
CID 5362769
(Z)-1-bromo-6-chlorohex-1-ene
CID 131240472
2-pent-4-enylcyclohexan-1-ol
CID 59087603
(Z)-7-[(1R,2S,4S)-2,4-dihydroxycyclopentyl]hept-5-enoic acid
CID 118934373
[(E)-5-bromopent-4-enyl]benzene
CID 15076450
(1S,2R,3S)-2-(7-hydroxyhepta-4,6-dienyl)-3-octylcyclopentan-1-ol
CID 154376350
2-(fluoromethyl)cyclopropan-1-ol
CID 84715966

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromopent-4-enyl)cyclopropan-1-ol?
The IUPAC name of 2-(5-bromopent-4-enyl)cyclopropan-1-ol (CID 123911328) is 2-(5-bromopent-4-enyl)cyclopropan-1-ol.
What is the SMILES notation for 2-(5-bromopent-4-enyl)cyclopropan-1-ol?
The canonical SMILES for 2-(5-bromopent-4-enyl)cyclopropan-1-ol is OC1CC1CCCC=CBr.
What is the InChIKey of 2-(5-bromopent-4-enyl)cyclopropan-1-ol?
The InChIKey is TZXVUMYHBLBHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13BrO/c9-5-3-1-2-4-7-6-8(7)10/h3,5,7-8,10H,1-2,4,6H2.
What are the key properties of 2-(5-bromopent-4-enyl)cyclopropan-1-ol?
2-(5-bromopent-4-enyl)cyclopropan-1-ol has a molecular weight of 205.09 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromopent-4-enyl)cyclopropan-1-ol is sourced from PubChem (CID 123911328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).