dimethyl(3-phenylpropyl)phosphane;hydrobromide

C11H18BrP — CID 173157759

IUPACdimethyl(3-phenylpropyl)phosphane;hydrobromide
SMILESBr.CP(C)CCCc1ccccc1
InChIInChI=1S/C11H17P.BrH/c1-12(2)10-6-9-11-7-4-3-5-8-11;/h3-5,7-8H,6,9-10H2,1-2H3;1H
InChIKeyHXDBKDXHMXNMBU-UHFFFAOYSA-N
MW261.14 g/mol
LogP3.94
Rot. Bonds4

About dimethyl(3-phenylpropyl)phosphane;hydrobromide

dimethyl(3-phenylpropyl)phosphane;hydrobromide (PubChem CID 173157759) has the molecular formula C11H18BrP and a molecular weight of 261.14 g/mol. Its IUPAC name is dimethyl(3-phenylpropyl)phosphane;hydrobromide.

Molecular Properties

Compound Namedimethyl(3-phenylpropyl)phosphane;hydrobromide
PubChem CID173157759
Molecular FormulaC11H18BrP
Molecular Weight261.14 g/mol
Exact Mass260.03
IUPAC Namedimethyl(3-phenylpropyl)phosphane;hydrobromide
SMILESBr.CP(C)CCCc1ccccc1
InChIInChI=1S/C11H17P.BrH/c1-12(2)10-6-9-11-7-4-3-5-8-11;/h3-5,7-8H,6,9-10H2,1-2H3;1H
InChIKeyHXDBKDXHMXNMBU-UHFFFAOYSA-N
XLogP3.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.14
LogP ≤ 53.94
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

dimethyl(3-phenylpropyl)phosphane
CID 15904260
dimethyl(4-phenylbutyl)phosphane
CID 67540805
dimethyl(7-phenylheptyl)phosphane;hydrochloride
CID 173157497
3-phenylpropyl-di(propan-2-yl)phosphane
CID 101080226
4-phenylbutylbenzene
CID 141301927
hafnium;4-phenylbutylbenzene
CID 175889972
1,4-bis(3-phenylpropyl)benzene
CID 59467322
methane;4-phenylbutylbenzene
CID 173386802
CID 159131095
CID 159131095
dodecylbenzene;sulfane
CID 20560423
4-(4-hexylphenyl)butyl-dimethylphosphane
CID 142018377
alumane;2-phenylethylbenzene;hydrobromide
CID 173446278

Frequently Asked Questions

What is the IUPAC name of dimethyl(3-phenylpropyl)phosphane;hydrobromide?
The IUPAC name of dimethyl(3-phenylpropyl)phosphane;hydrobromide (CID 173157759) is dimethyl(3-phenylpropyl)phosphane;hydrobromide.
What is the SMILES notation for dimethyl(3-phenylpropyl)phosphane;hydrobromide?
The canonical SMILES for dimethyl(3-phenylpropyl)phosphane;hydrobromide is Br.CP(C)CCCc1ccccc1.
What is the InChIKey of dimethyl(3-phenylpropyl)phosphane;hydrobromide?
The InChIKey is HXDBKDXHMXNMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17P.BrH/c1-12(2)10-6-9-11-7-4-3-5-8-11;/h3-5,7-8H,6,9-10H2,1-2H3;1H.
What are the key properties of dimethyl(3-phenylpropyl)phosphane;hydrobromide?
dimethyl(3-phenylpropyl)phosphane;hydrobromide has a molecular weight of 261.14 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(3-phenylpropyl)phosphane;hydrobromide is sourced from PubChem (CID 173157759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).