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Sulforhodamine 101

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Name

Sulforhodamine 101

EINECS 262-159-4
CAS No. 60311-02-6 Density 1.1982 (rough estimate)
PSA 143.81000 LogP 4.59910
Solubility N/A Melting Point N/A
Formula C31H30N2O7S2 Boiling Point N/A
Molecular Weight 606.72 Flash Point N/A
Transport Information N/A Appearance green to dark green crystalline powder
Safety 22-24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 60311-02-6 (SULFORHODAMINE 101) Hazard Symbols N/A
Synonyms

1H,5H,11H,15H-Xantheno[2,3,4-ij:5,6,7-i'j']diquinolizin-18-ium,9-(2,4-disulfophenyl)-2,3,6,7,12,13,16,17-octahydro-, hydroxide, inner salt;LC6600;SR 101;Sulforhodamine 101;Sulforhodamine 640;

Article Data 6

Sulforhodamine 101 Specification

The Sulforhodamine 101 with its cas register number is 60311-02-6. It also can be called as Hydrogen 9-(2,4-disulphonatophenyl)-2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-xantheno[2,3,4-ij:5,6,7-i'j']diquinolizin-18-ium and the Systematic name about this chemical is 4-(2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-pyrido[3,2,1-ij]quinolizino[1',9':6,7,8]chromeno[2,3-f]quinolin-4-ium-9-yl)benzene-1,3-disulfonate. It belongs to the following product categories, such as S, Stains and Dyes, Stains&Dyes, A to and so on. When you are using it, please not breathe dust and avoid contact with skin and eyes.

Physical properties about Sulforhodamine 101 are: (1)#H bond acceptors: 9 ; (2)#H bond donors: 2 ; (3)#Freely Rotating Bonds: 3 ; (4)Polar Surface Area: 140.98Å2 ; (5)Rotatable Bond Count: 2; (6)Exact Mass: 606.149443; (7)MonoIsotopic Mass: 606.149443; (8)Topological Polar Surface Area: 144; (9)Heavy Atom Count: 42.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC2=C3C(=C4C(=C2)C(=C5C=C6CCC[N+]7=C6C(=C5O4)CCC7)C8=C(C=C(C=C8)S(=O)(=O)O)S(=O)(=O)[O-])CCCN3C1
(2)InChI: InChI=1S/C31H30N2O7S2/c34-41(35,36)20-9-10-21(26(17-20)42(37,38)39)27-24-15-18-5-1-11-32-13-3-7-22(28(18)32)30(24)40-31-23-8-4-14-33-12-2-6-19(29(23)33)16-25(27)31/h9-10,15-17H,1-8,11-14H2,(H-,34,35,36,37,38,39)
(3)InChIKey: COIVODZMVVUETJ-UHFFFAOYSA-N

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