Products Categories
| CAS No.: | 116-95-0 |
|---|---|
| Name: | ACID BLUE 1 |
| Molecular Structure: | |
|
|
|
| Formula: | C27H31N2NaO6S2 |
| Molecular Weight: | 544.68 |
| Synonyms: | C.I. AcidBlue 1 (8CI);Ethanaminium,N-[4-[[4-(diethylamino)phenyl](2,4-disulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-,hydroxide, inner salt; |
| EINECS: | 204-934-1 |
| Solubility: | Soluble in water |
| Safety: | 24/25 |
| PSA: | 137.41000 |
| LogP: | 5.92380 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 1219080-61-1IMIDAZOLE-2-BORONIC ACID
- Total:38 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The Ethanaminium,N-[4-[[4-(diethylamino)phenyl](2,4-disulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-,inner salt, with the CAS registry number 116-95-0, is also known as C.I. AcidBlue 1 (8CI). Its EINECS number is 204-934-1. This chemical's molecular formula is C27H31N2NaO6S2 and molecular weight is 544.68. What's more, its systematic name is 4-{[4-(diethylamino)phenyl][4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene]methyl}-3-sulfobenzenesulfonate.
Physical properties of Ethanaminium,N-[4-[[4-(diethylamino)phenyl](2,4-disulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-,inner salt are: (1)#H bond acceptors: 8; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 9; (4)Polar Surface Area: 120.75 Å2.
When you are using this chemical, please be cautious about it as the following:
It should be avoided contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-]S(=O)(=O)c1ccc(c(c1)S(=O)(=O)O)C(=C2/C=C\C(=[N+](/CC)CC)\C=C2)\c3ccc(N(CC)CC)cc3
(2)InChI: InChI=1/C27H32N2O6S2/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-18-17-24(36(30,31)32)19-26(25)37(33,34)35/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35)
(3)InChIKey: IKHKJYWPWWBSFZ-UHFFFAOYAZ