(2-bromophenyl)-phenyl-propan-2-ylphosphane

C15H16BrP — CID 62705964

IUPAC(2-bromophenyl)-phenyl-propan-2-ylphosphane
SMILESCC(C)[P@@](c1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H16BrP/c1-12(2)17(13-8-4-3-5-9-13)15-11-7-6-10-14(15)16/h3-12H,1-2H3/t17-/m0/s1
InChIKeyVZFXSXGDFALSQY-KRWDZBQOSA-N
MW307.17 g/mol
LogP4.29
Rot. Bonds3

About (2-bromophenyl)-phenyl-propan-2-ylphosphane

(2-bromophenyl)-phenyl-propan-2-ylphosphane (PubChem CID 62705964) has the molecular formula C15H16BrP and a molecular weight of 307.17 g/mol. Its IUPAC name is (2-bromophenyl)-phenyl-propan-2-ylphosphane.

Molecular Properties

Compound Name(2-bromophenyl)-phenyl-propan-2-ylphosphane
PubChem CID62705964
Molecular FormulaC15H16BrP
Molecular Weight307.17 g/mol
Exact Mass306.02
IUPAC Name(2-bromophenyl)-phenyl-propan-2-ylphosphane
SMILESCC(C)[P@@](c1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H16BrP/c1-12(2)17(13-8-4-3-5-9-13)15-11-7-6-10-14(15)16/h3-12H,1-2H3/t17-/m0/s1
InChIKeyVZFXSXGDFALSQY-KRWDZBQOSA-N
XLogP4.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.17
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-phenyl-propan-2-ylphosphane?
The IUPAC name of (2-bromophenyl)-phenyl-propan-2-ylphosphane (CID 62705964) is (2-bromophenyl)-phenyl-propan-2-ylphosphane.
What is the SMILES notation for (2-bromophenyl)-phenyl-propan-2-ylphosphane?
The canonical SMILES for (2-bromophenyl)-phenyl-propan-2-ylphosphane is CC(C)[P@@](c1ccccc1)c1ccccc1Br.
What is the InChIKey of (2-bromophenyl)-phenyl-propan-2-ylphosphane?
The InChIKey is VZFXSXGDFALSQY-KRWDZBQOSA-N. The full InChI is InChI=1S/C15H16BrP/c1-12(2)17(13-8-4-3-5-9-13)15-11-7-6-10-14(15)16/h3-12H,1-2H3/t17-/m0/s1.
What are the key properties of (2-bromophenyl)-phenyl-propan-2-ylphosphane?
(2-bromophenyl)-phenyl-propan-2-ylphosphane has a molecular weight of 307.17 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-phenyl-propan-2-ylphosphane is sourced from PubChem (CID 62705964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).