Bis(di-tert-butylphosphino)methane

• CAS: 87648-10-0
• Catalog Number: ACM87648100-1
• Category: Organic Phosphine Compounds
• Molecular Weight: 304.44
• Molecular Formula: C17H38P2
• Synonyms: Di(tert-butyl)([di(tert-butyl)phosphino]methyl)phosphine #; CTK2I2261; Bis(ditert-butylphosphino)methane; Methane, bis(di-t-butylphosphino)-; bis(di-t-butylphosphino)methane; MFCD01074549; FT-0769032; 87648-10-0; DB-005415
• IUPAC Name: ditert-butyl(ditert-butylphosphanylmethyl)phosphane
• Canonical SMILES: CC(C)(C)P(CP(C(C)(C)C)C(C)(C)C)C(C)(C)C
• InChI: WBMJFMFJCWPAIT-UHFFFAOYSA-N
• InChI Key: InChI=1S/C17H38P2/c1-14(2,3)18(15(4,5)6)13-19(16(7,8)9)17(10,11)12/h13H2,1-12H3
• Boiling Point: 75-80 °C(Press: 0.0008 Torr)
• Appearance: Solid
• Complexity: 220
• Covalently-Bonded Unit Count: 1
• Exact Mass: 304.245g/mol
• Heavy Atom Count: 19
• Isomeric SMILES: CC(C)(C)P(CP(C(C)(C)C)C(C)(C)C)C(C)(C)C
• Monoisotopic Mass: 304.245g/mol
• Rotatable Bond Count: 6
• Topological Polar Surface Area: 0A^2

Custom Q&A

What is the molecular formula of bis(di-tert-butylphosphino)methane?

The molecular formula is C17H38P2.

What is the molecular weight of bis(di-tert-butylphosphino)methane?

The molecular weight is 304.4 g/mol.

What is the IUPAC name of bis(di-tert-butylphosphino)methane?

The IUPAC name is ditert-butyl(ditert-butylphosphanylmethyl)phosphane.

What is the InChIKey of bis(di-tert-butylphosphino)methane?

The InChIKey is WBMJFMFJCWPAIT-UHFFFAOYSA-N.

What is the Canonical SMILES of bis(di-tert-butylphosphino)methane?

The Canonical SMILES is CC(C)(C)P(CP(C(C)(C)C)C(C)(C)C)C(C)(C)C.

What is the XLogP3-AA value for bis(di-tert-butylphosphino)methane?

The XLogP3-AA value is 3.7.

How many hydrogen bond donor counts does bis(di-tert-butylphosphino)methane have?

It has 0 hydrogen bond donor counts.

How many rotatable bond counts does bis(di-tert-butylphosphino)methane have?

It has 6 rotatable bond counts.

What is the topological polar surface area of bis(di-tert-butylphosphino)methane?

The topological polar surface area is 0Ų.

Is the compound canonicalized for bis(di-tert-butylphosphino)methane?

Yes, the compound is canonicalized.