(3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine

Catalog Number	ACM840504214
CAS	840504-21-4
Structure
Synonyms	(1S,7S)-4-Dimethylamino-9,9-Dimethyl-2,2,6,6-Tetrakis(3,5-Dimethylphenyl)-3,5,8,10-Tetraoxa-4-Phosphabicyclo[5.3.0]Decane
IUPAC Name	(3aS,8aS)-4,4,8,8-tetrakis(3,5-dimethylphenyl)-N,N,2,2-tetramethyl-3a,8a-dihydro-[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine
Molecular Weight	651.81
Molecular Formula	C41H50NO4P
InChI	MQWIRJLCMSDPCG-UWXQCODUSA-N
InChI Key	InChI=1S/C41H50NO4P/c1-25-13-26(2)18-33(17-25)40(34-19-27(3)14-28(4)20-34)37-38(44-39(9,10)43-37)41(46-47(45-40)42(11)12,35-21-29(5)15-30(6)22-35)36-23-31(7)16-32(8)24-36/h13-24,37-38H,1-12H3/t37-,38-/m0/s1
Boiling Point	645.8±55.0 °C(Predicted)
Purity	95%
Isomeric SMILES	CC1=CC(=CC(=C1)C2([C@@H]3[C@@H](C(OP(O2)N(C)C)(C4=CC(=CC(=C4)C)C)C5=CC(=CC(=C5)C)C)OC(O3)(C)C)C6=CC(=CC(=C6)C)C)C

Q&A

What is the chemical structure of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The chemical structure of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine.

What is the Canonical SMILES of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The Canonical SMILES of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is CC1=CC(=CC(=C1)C2(C3C(C(OP(O2)N(C)C)(C4=CC(=CC(=C4)C)C)C5=CC(=CC(=C5)C)C)OC(O3)(C)C)C6=CC(=CC(=C6)C)C)C.

What is the Computed Properties Heavy Atom Count for (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The Computed Properties Heavy Atom Count for (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is 47.

How many Hydrogen Bond Acceptor Count does (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine have?

(3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine has 5 Hydrogen Bond Acceptor Count.

What is the InChIKey of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The InChIKey of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is MQWIRJLCMSDPCG-UWXQCODUSA-N.

What is the Molecular Formula of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The Molecular Formula of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is C41H50NO4P.

What is the Molecular Weight of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The Molecular Weight of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is 651.8g/mol.

What is the Monoisotopic Mass of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The Monoisotopic Mass of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is 651.34774607.

What is the Depositor-Supplied Synonym for (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

One of the Depositor-Supplied Synonyms for (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is AKOS040768307.

What is the IUPAC Name of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine?

The IUPAC Name of (3aS,8aS)-4,4,8,8-Tetrakis(3,5-dimethylphenyl)tetrahydro-N,N,2,2-tetramethyl-1,3-dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine is (3aS,8aS)-4,4,8,8-tetrakis(3,5-dimethylphenyl)-N,N,2,2-tetramethyl-3a,8a-dihydro-[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-amine.