benzyl-bromo-propylphosphane

C10H14BrP — CID 139995622

IUPACbenzyl-bromo-propylphosphane
SMILESCCCP(Br)Cc1ccccc1
InChIInChI=1S/C10H14BrP/c1-2-8-12(11)9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKeyRLXFZDIADBFPQE-UHFFFAOYSA-N
MW245.10 g/mol
LogP4.39
Rot. Bonds4

About benzyl-bromo-propylphosphane

benzyl-bromo-propylphosphane (PubChem CID 139995622) has the molecular formula C10H14BrP and a molecular weight of 245.10 g/mol. Its IUPAC name is benzyl-bromo-propylphosphane.

Molecular Properties

Compound Namebenzyl-bromo-propylphosphane
PubChem CID139995622
Molecular FormulaC10H14BrP
Molecular Weight245.10 g/mol
Exact Mass244.00
IUPAC Namebenzyl-bromo-propylphosphane
SMILESCCCP(Br)Cc1ccccc1
InChIInChI=1S/C10H14BrP/c1-2-8-12(11)9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKeyRLXFZDIADBFPQE-UHFFFAOYSA-N
XLogP4.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.10
LogP ≤ 54.39
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

benzyl-methyl-propylphosphane
CID 13024967
benzyl-butyl-ethylphosphane
CID 54234955
palladium;bis(tribenzylphosphane)
CID 87652258
benzyl(diethoxy)phosphane
CID 13274714
[benzyl-(tetrabutyl-λ5-phosphanyl)oxyphosphanyl]oxy-tetrabutyl-λ5-phosphane
CID 139962612
(2S)-2-[benzyl(propyl)phosphanyl]-1-methoxypropan-2-amine
CID 174273124
ethylcyclodecapentaene
CID 90861705
dichloronickel;bis(diphenyl(propyl)phosphane)
CID 87129784
dichloroiron;diphenyl(propyl)phosphane
CID 175149268
propylbenzene;hydrobromide
CID 70024036
propylbenzene tetraiodide
CID 23321652
ethylbenzene;oxalonitrile;sulfane
CID 174327250

Frequently Asked Questions

What is the IUPAC name of benzyl-bromo-propylphosphane?
The IUPAC name of benzyl-bromo-propylphosphane (CID 139995622) is benzyl-bromo-propylphosphane.
What is the SMILES notation for benzyl-bromo-propylphosphane?
The canonical SMILES for benzyl-bromo-propylphosphane is CCCP(Br)Cc1ccccc1.
What is the InChIKey of benzyl-bromo-propylphosphane?
The InChIKey is RLXFZDIADBFPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrP/c1-2-8-12(11)9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3.
What are the key properties of benzyl-bromo-propylphosphane?
benzyl-bromo-propylphosphane has a molecular weight of 245.10 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-bromo-propylphosphane is sourced from PubChem (CID 139995622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).