boranyl-bis(4-methylphenyl)phosphane

C14H16BP — CID 101471392

IUPACboranyl-bis(4-methylphenyl)phosphane
SMILESBP(c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C14H16BP/c1-11-3-7-13(8-4-11)16(15)14-9-5-12(2)6-10-14/h3-10H,15H2,1-2H3
InChIKeyRXFIKTZMCHCVMQ-UHFFFAOYSA-N
MW226.07 g/mol
LogP2.28
Rot. Bonds2

About boranyl-bis(4-methylphenyl)phosphane

boranyl-bis(4-methylphenyl)phosphane (PubChem CID 101471392) has the molecular formula C14H16BP and a molecular weight of 226.07 g/mol. Its IUPAC name is boranyl-bis(4-methylphenyl)phosphane.

Molecular Properties

Compound Nameboranyl-bis(4-methylphenyl)phosphane
PubChem CID101471392
Molecular FormulaC14H16BP
Molecular Weight226.07 g/mol
Exact Mass226.11
IUPAC Nameboranyl-bis(4-methylphenyl)phosphane
SMILESBP(c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C14H16BP/c1-11-3-7-13(8-4-11)16(15)14-9-5-12(2)6-10-14/h3-10H,15H2,1-2H3
InChIKeyRXFIKTZMCHCVMQ-UHFFFAOYSA-N
XLogP2.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.07
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 58850517
CID 58850517
platinum;tris(tris(4-methylphenyl)phosphane)
CID 71361072
ethane;tris(4-methylphenyl)phosphane
CID 145151678
cobalt(2+);bis(tris(4-methylphenyl)phosphane);dichloride
CID 161245317
1-[amino(methyl)phosphanyl]-4-methylbenzene
CID 142150804
diiodopalladium;bis(tris(4-methylphenyl)phosphane)
CID 23037656
1-[amino-(4-methylphenyl)phosphanyl]-4-methylbenzene;hydrochloride
CID 175443609
cobalt;bis(1,4-xylene)
CID 67859603
methane;pentakis(1,4-xylene)
CID 160760083
platinum;1,4-xylene
CID 173034643
(4-methylphenyl)-[4-[(4-methylphenyl)-phenylphosphanyl]phenyl]-phenylphosphane
CID 141372825
(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane
CID 129275176

Frequently Asked Questions

What is the IUPAC name of boranyl-bis(4-methylphenyl)phosphane?
The IUPAC name of boranyl-bis(4-methylphenyl)phosphane (CID 101471392) is boranyl-bis(4-methylphenyl)phosphane.
What is the SMILES notation for boranyl-bis(4-methylphenyl)phosphane?
The canonical SMILES for boranyl-bis(4-methylphenyl)phosphane is BP(c1ccc(C)cc1)c1ccc(C)cc1.
What is the InChIKey of boranyl-bis(4-methylphenyl)phosphane?
The InChIKey is RXFIKTZMCHCVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BP/c1-11-3-7-13(8-4-11)16(15)14-9-5-12(2)6-10-14/h3-10H,15H2,1-2H3.
What are the key properties of boranyl-bis(4-methylphenyl)phosphane?
boranyl-bis(4-methylphenyl)phosphane has a molecular weight of 226.07 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for boranyl-bis(4-methylphenyl)phosphane is sourced from PubChem (CID 101471392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).