benzyl(trimethyl)phosphanium;hydrochloride

C10H17ClP+ — CID 154945285

IUPACbenzyl(trimethyl)phosphanium;hydrochloride
SMILESC[P+](C)(C)Cc1ccccc1.Cl
InChIInChI=1S/C10H16P.ClH/c1-11(2,3)9-10-7-5-4-6-8-10;/h4-8H,9H2,1-3H3;1H/q+1;
InChIKeyTXXACRDXEHKXKD-UHFFFAOYSA-N
MW203.67 g/mol
LogP3.52
Rot. Bonds2

About benzyl(trimethyl)phosphanium;hydrochloride

benzyl(trimethyl)phosphanium;hydrochloride (PubChem CID 154945285) has the molecular formula C10H17ClP+ and a molecular weight of 203.67 g/mol. Its IUPAC name is benzyl(trimethyl)phosphanium;hydrochloride.

Molecular Properties

Compound Namebenzyl(trimethyl)phosphanium;hydrochloride
PubChem CID154945285
Molecular FormulaC10H17ClP+
Molecular Weight203.67 g/mol
Exact Mass203.08
IUPAC Namebenzyl(trimethyl)phosphanium;hydrochloride
SMILESC[P+](C)(C)Cc1ccccc1.Cl
InChIInChI=1S/C10H16P.ClH/c1-11(2,3)9-10-7-5-4-6-8-10;/h4-8H,9H2,1-3H3;1H/q+1;
InChIKeyTXXACRDXEHKXKD-UHFFFAOYSA-N
XLogP3.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 53.52
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(trimethyl)phosphanium;hydrobromide
CID 154945301
2-(1-phenylpropan-2-ylsulfanyl)propylbenzene
CID 54020094
ethane;2-methylpropylbenzene
CID 162200929
benzyl-methyl-dipropylphosphanium
CID 23546516
λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
trimethyl(2-phenylethyl)phosphanium
CID 10777798
(2-benzyl-3-methylbutyl)benzene
CID 22277918
2,3-dimethylbutylbenzene
CID 12054035
tribenzyl(ethyl)phosphanium
CID 23415376
benzenesulfonate;bis(tribenzyl(methyl)phosphanium)
CID 158781349
1-[benzyl(1-hydroxyethyl)amino]ethanol;hydrochloride
CID 173430538
CID 66672385
CID 66672385

Frequently Asked Questions

What is the IUPAC name of benzyl(trimethyl)phosphanium;hydrochloride?
The IUPAC name of benzyl(trimethyl)phosphanium;hydrochloride (CID 154945285) is benzyl(trimethyl)phosphanium;hydrochloride.
What is the SMILES notation for benzyl(trimethyl)phosphanium;hydrochloride?
The canonical SMILES for benzyl(trimethyl)phosphanium;hydrochloride is C[P+](C)(C)Cc1ccccc1.Cl.
What is the InChIKey of benzyl(trimethyl)phosphanium;hydrochloride?
The InChIKey is TXXACRDXEHKXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16P.ClH/c1-11(2,3)9-10-7-5-4-6-8-10;/h4-8H,9H2,1-3H3;1H/q+1;.
What are the key properties of benzyl(trimethyl)phosphanium;hydrochloride?
benzyl(trimethyl)phosphanium;hydrochloride has a molecular weight of 203.67 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl(trimethyl)phosphanium;hydrochloride is sourced from PubChem (CID 154945285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).