N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline

Catalog Number	ACM1859092548
CAS	1859092-54-8
IUPAC Name	N-(1-dicyclohexylphosphanyl-2,2-dimethylpropyl)-2,4,6-trimethylaniline
Molecular Weight	401.61
Molecular Formula	C26H44NP
InChI	VBAUENDSTCVFES-UHFFFAOYSA-N
InChI Key	InChI=1S/C26H44NP/c1-19-17-20(2)24(21(3)18-19)27-25(26(4,5)6)28(22-13-9-7-10-14-22)23-15-11-8-12-16-23/h17-18,22-23,25,27H,7-16H2,1-6H3
Purity	98%
Isomeric SMILES	CC1=CC(=C(C(=C1)C)NC(C(C)(C)C)P(C2CCCCC2)C3CCCCC3)C

Q&A

What is the molecular formula of N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The molecular formula is C26H44NP.

What is the exact mass of N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The exact mass is 401.32113741.

Can you provide the Canonical SMILES for N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The Canonical SMILES is CC1=CC(=C(C(=C1)C)NC(C(C)(C)C)P(C2CCCCC2)C3CCCCC3)C.

How many heavy atoms are present in N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

There are 28 heavy atoms.

What is the IUPAC name of N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The IUPAC name is N-(1-dicyclohexylphosphanyl-2,2-dimethylpropyl)-2,4,6-trimethylaniline.

How many covalently bonded units are there in N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

There is 1 covalently bonded unit.

What is the computed XLogP3 value for N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The computed XLogP3 value is 8.2.

What is the InChIKey for N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The InChIKey is VBAUENDSTCVFES-UHFFFAOYSA-N.

How many rotatable bonds are present in the structure of N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

There are 6 rotatable bonds.

What is the molecular weight of N-(1-(Dicyclohexylphosphino)-2,2-dimethylpropyl)-2,4,6-trimethylaniline?

The molecular weight is 401.6g/mol.