Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate

Catalog Number	ACM443150116-1
CAS	443150-11-6
Structure
Synonyms	TXPTS
IUPAC Name	trisodium;5-bis(2,4-dimethyl-5-sulfonatophenyl)phosphanyl-2,4-dimethylbenzenesulfonate
Molecular Weight	652.58
Molecular Formula	C24H24Na3O9PS3
InChI	YVYHEZNITVEWDK-UHFFFAOYSA-K
InChI Key	InChI=1S/C24H27O9PS3.3Na/c1-13-7-16(4)22(35(25,26)27)10-19(13)34(20-11-23(36(28,29)30)17(5)8-14(20)2)21-12-24(37(31,32)33)18(6)9-15(21)3;;;/h7-12H,1-6H3,(H,25,26,27)(H,28,29,30)(H,31,32,33);;;/q;3*+1/p-3
Melting Point	>300 °C
Appearance	Solid
Isomeric SMILES	CC1=CC(=C(C=C1P(C2=CC(=C(C=C2C)C)S(=O)(=O)[O-])C3=CC(=C(C=C3C)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+].[Na+]

Q&A

What is the CAS number of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The CAS number is 443150-11-6.

What is the Canonical SMILES representation of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

CC1=CC(=C(C=C1P(C2=CC(=C(C=C2C)C)S(=O)(=O)[O-])C3=CC(=C(C=C3C)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C.O.[Na+].[Na+].[Na+]

What is the molecular formula of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The molecular formula is C24H26Na3O10PS3.

What is the molecular weight of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The molecular weight is 670.6 g/mol.

How many hydrogen bond acceptors are there in Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

There are 10 hydrogen bond acceptors.

How many rotatable bonds are there in Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

There are 3 rotatable bonds.

What is the IUPAC name of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The IUPAC name is trisodium;5-bis(2,4-dimethyl-5-sulfonatophenyl)phosphanyl-2,4-dimethylbenzenesulfonate;hydrate.

What is the exact mass of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The exact mass is 670.01188039.

What is the InChIKey of Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

The InChIKey is LBWMFZIYNLEWAE-UHFFFAOYSA-K.

How many heavy atoms are present in Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate Tris(4,6-dimethyl-3-sulfonatophenyl)phosphine trisodium salt hydrate?

There are 41 heavy atoms.