bromo(cyclopentylmethyl)phosphane

C12H24Br2P2 — CID 139995664

IUPACbromo(cyclopentylmethyl)phosphane
SMILESBrPCC1CCCC1.BrPCC1CCCC1
InChIInChI=1S/2C6H12BrP/c2*7-8-5-6-3-1-2-4-6/h2*6,8H,1-5H2
InChIKeyZRQDMDKQNWMUAP-UHFFFAOYSA-N
MW390.08 g/mol
LogP6.33
Rot. Bonds4

About bromo(cyclopentylmethyl)phosphane

bromo(cyclopentylmethyl)phosphane (PubChem CID 139995664) has the molecular formula C12H24Br2P2 and a molecular weight of 390.08 g/mol. Its IUPAC name is bromo(cyclopentylmethyl)phosphane.

Molecular Properties

Compound Namebromo(cyclopentylmethyl)phosphane
PubChem CID139995664
Molecular FormulaC12H24Br2P2
Molecular Weight390.08 g/mol
Exact Mass387.97
IUPAC Namebromo(cyclopentylmethyl)phosphane
SMILESBrPCC1CCCC1.BrPCC1CCCC1
InChIInChI=1S/2C6H12BrP/c2*7-8-5-6-3-1-2-4-6/h2*6,8H,1-5H2
InChIKeyZRQDMDKQNWMUAP-UHFFFAOYSA-N
XLogP6.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.08
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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[4-(cyclopentylmethyl)cyclohexyl]methylcycloheptane
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2-bromo-3-cyclohexyl-1-cyclopropylpropan-1-one
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cyclotetradecylmethanol
CID 23468347
chromium;bis(ethylcyclopentane)
CID 91996240
ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
CID 160752471
bromo(cyclohexyl)phosphane
CID 169216983
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
CID 57418033
CID 57418033
ethane;bis(ethylcyclopentane)
CID 158911237

Frequently Asked Questions

What is the IUPAC name of bromo(cyclopentylmethyl)phosphane?
The IUPAC name of bromo(cyclopentylmethyl)phosphane (CID 139995664) is bromo(cyclopentylmethyl)phosphane.
What is the SMILES notation for bromo(cyclopentylmethyl)phosphane?
The canonical SMILES for bromo(cyclopentylmethyl)phosphane is BrPCC1CCCC1.BrPCC1CCCC1.
What is the InChIKey of bromo(cyclopentylmethyl)phosphane?
The InChIKey is ZRQDMDKQNWMUAP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H12BrP/c2*7-8-5-6-3-1-2-4-6/h2*6,8H,1-5H2.
What are the key properties of bromo(cyclopentylmethyl)phosphane?
bromo(cyclopentylmethyl)phosphane has a molecular weight of 390.08 g/mol, XLogP of 6.33, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(cyclopentylmethyl)phosphane is sourced from PubChem (CID 139995664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).