(R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide

Catalog Number	ACM1616688631
CAS	1616688-63-1
Structure
Synonyms	[S(R)]-N-[(S)-[3,5-Bis(1,1-dimethylethyl)-4-methoxyphenyl][2-(diphenylphosphino)phenyl]methyl]-2-methyl-2-propanesulfinamide
IUPAC Name	N-[(S)-(3,5-ditert-butyl-4-methoxyphenyl)-(2-diphenylphosphanylphenyl)methyl]-2-methylpropane-2-sulfinamide
Molecular Weight	613.83
Molecular Formula	C38H48NO2PS
InChI	JIJHYOCKCFKMDP-RGQUUCBMSA-N
InChI Key	InChI=1S/C38H48NO2PS/c1-36(2,3)31-25-27(26-32(35(31)41-10)37(4,5)6)34(39-43(40)38(7,8)9)30-23-17-18-24-33(30)42(28-19-13-11-14-20-28)29-21-15-12-16-22-29/h11-26,34,39H,1-10H3/t34-,43?/m0/s1
Purity	98%
Isomeric SMILES	CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)[C@@H](C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4)NS(=O)C(C)(C)C

Q&A

What is the molecular formula of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The molecular formula is C38H48NO2PS.

What is the molecular weight of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The molecular weight is 613.8 g/mol.

What is the exact mass of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The exact mass is 613.31433795.

How many heavy atoms are present in (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

There are 43 heavy atoms.

How many rotatable bonds are present in (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

There are 11 rotatable bonds.

What is the topological polar surface area of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The topological polar surface area is 57.5.

Can you provide the Canonical SMILES of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4)NS(=O)C(C)(C)C

What are some synonyms of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

Some synonyms include [S(R)]-N-[(S)-[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl][2-(diphenylphosphino)phenyl]methyl]-2-methyl-2-propanesulfinamide, and N-[(S)-(3,5-ditert-butyl-4-methoxyphenyl)-(2-diphenylphosphanylphenyl)methyl]-2-methylpropane-2-sulfinamide.

What is the InChIKey of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The InChIKey is JIJHYOCKCFKMDP-RGQUUCBMSA-N.

What is the IUPAC name of (R)-N-((S)-(3,5-Di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide?

The IUPAC name is N-[(S)-(3,5-ditert-butyl-4-methoxyphenyl)-(2-diphenylphosphanylphenyl)methyl]-2-methylpropane-2-sulfinamide.