CAS No.6223-35-4,Sodium gualenate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6223-35-4
Name:	Sodium gualenate
Article Data:	5

Formula:	C₁₅H₁₇NaO₃S
Molecular Weight:	300.354
Synonyms:	1-Azulenesulfonicacid, 3,8-dimethyl-5-(1-methylethyl)-, sodium salt (9CI);1-Azulenesulfonicacid, 5-isopropyl-3,8-dimethyl-, sodium salt (7CI,8CI);Azulen SN;Azulene SN;Azunol ST;Azupromin;Guaiazulene 3-sulfonate sodium salt;Guaiazulene soluble;Sodium 1,4-dimethyl-7-isopropylazulene-3-sulfonate;Sodium3-methyl-5-isopropyl-8-methylazulenesulfonate;Sodium5-isopropyl-3,8-dimethyl-1-azulenesulfonate;Sodium7-isopropyl-1,4-dimethylazulene-3-sulfonate;Sodium guaiazulene-3-sulfonate;Sodium guaiazulenesulfonate;
EINECS:	228-309-8
Melting Point:	98°C(lit.)
PSA:	65.58000
LogP:	4.51650

Synthetic route

: 489-84-9
7-isopropyl-1,4-dimethyl-azulene

: 6223-35-4
Azulon

Conditions

Conditions	Yield
With sulfuric acid; acetic anhydride at 20℃; for 2h; Cooling with ice;	87.5%
Stage #1: 7-isopropyl-1,4-dimethyl-azulene With sulfuric acid; acetic anhydride at 20℃; for 4h; Stage #2: With sodium hydroxide In water	57%
Multi-step reaction with 2 steps 1: sulfuric acid; acetic anhydride / 3 h / 20 °C 2: sodium hydroxide View Scheme
Stage #1: 7-isopropyl-1,4-dimethyl-azulene With sulfuric acid; acetic anhydride at 20℃; for 3h; Stage #2: With sodium hydroxide

: 16915-32-5
5-isopropyl-3,8-dimethyl-azulene-1-sulfonic acid

: 6223-35-4
Azulon

Conditions

Conditions	Yield
With sodium hydroxide

: 110-85-0
piperazine

: 6223-35-4
Azulon

: 1-((5-isopropyl-3,8-dimethylazulen-1-yl)sulfonyl)piperazine

Conditions

Conditions	Yield
Stage #1: Azulon With pyridine; oxalyl dichloride In dichloromethane Stage #2: piperazine With pyridine; triethylamine	43%

: 6223-35-4
Azulon

: 1338350-96-1
N-ethyl-3,8-dimethyl-5-isopropyl-1-azulene sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: N,N-dimethyl-formamide; pyridine; oxalyl dichloride / dichloromethane / Cooling with ice 2: triethylamine; pyridine / dichloromethane / 1 h / 20 °C View Scheme

: 6223-35-4
Azulon

: 1338350-97-2
N-cyclohexyl-3,8-dimethyl-5-isopropyl-1-azulene sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: N,N-dimethyl-formamide; pyridine; oxalyl dichloride / dichloromethane / Cooling with ice 2: triethylamine; pyridine / dichloromethane / 1 h / 20 °C View Scheme

: 6223-35-4
Azulon

: 1338350-98-3
N-benzyl-3,8-dimethyl-5-isopropyl-1-azulene sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: N,N-dimethyl-formamide; pyridine; oxalyl dichloride / dichloromethane / Cooling with ice 2: triethylamine; pyridine / dichloromethane / 1 h / 20 °C View Scheme

: 6223-35-4
Azulon

: 1338350-99-4
N-(4-chlorophenyl)-3,8-dimethyl-5-isopropyl-1-azulene sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: N,N-dimethyl-formamide; pyridine; oxalyl dichloride / dichloromethane / Cooling with ice 2: triethylamine; pyridine / dichloromethane / 1 h / 20 °C View Scheme

: 6223-35-4
Azulon

: 1338351-00-0
N-(4-aminophenyl)-3,8-dimethyl-5-isopropyl-1-azulene sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: N,N-dimethyl-formamide; pyridine; oxalyl dichloride / dichloromethane / Cooling with ice 2: triethylamine; pyridine / dichloromethane / 1 h / 20 °C View Scheme
Multi-step reaction with 3 steps 1: thionyl chloride / dichloromethane / 4 h / 0 °C 2: dichloromethane / 12 h 3: trifluoroacetic acid / dichloromethane / 3 h View Scheme

: 6223-35-4
Azulon

: 1338351-02-2
N-[4-(benzylideneamino)phenyl]-5-isopropyl-3,8-dimethylazulene-1-sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C 3: ethanol / 1 h / 20 °C View Scheme

: 6223-35-4
Azulon

: 1338351-03-3
N-[4-(2-hydroxybenzylideneamino)phenyl]-5-isopropyl-3,8-dimethylazulene-1-sulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: pyridine; oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0.17 h / Cooling with ice 2: pyridine; triethylamine / dichloromethane / 1 h / 20 °C 3: ethanol / 1 h / 20 °C View Scheme

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Chemistry

Molecular Structure:

Molecular Formula: C₁₅H₁₇NaO₃S
Molecular Weight: 300.3484
IUPAC Name: Sodium 3,8-dimethyl-5-propan-2-ylazulene-1-sulfonate
Synonyms of Sodium gualenate (CAS NO.6223-35-4): 3,8-Dimethyl-5-(1-methylethyl)-1-azulenesulfonic acid sodium salt ; Azulen SN ; Azulon ; Azupromin ; CCRIS 3781 ; EINECS 228-309-8 ; Guajazulen-3-sulfonsaeure, natriumsalz ; Gualenate de sodium ; Gualenate de sodium [INN-French] ; Gualenato sodico ; Gualenato sodico [INN-Spanish] ; Gualenato sodidico ; Natrii gualenas ; Natrii gualenas [INN-Latin] ; Natrium 7-isopropyl-1,4-dimethyl-3-azulensulfonat ; Sodium 5-isopropyl-3,8-dimethyl-1-azulene sulfonate ; Sodium 7-isopropyl-1,4-dimethylazulene-3-sulfonate ; Sodium guaiazulene-3-sulfonate ; UNII-19WSH095WP ; 1-Azulenesulfonic acid, 3,8-dimethyl-5-(1-methylethyl)-, sodium salt (9CI) ; 1-Azulenesulfonic acid, 5-isopropyl-3,8-dimethyl-, sodium salt ; Azuletil sodium
CAS NO: 6223-35-4
Product Categories: Drug / Therapeutic Agent

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	105mg/kg (105mg/kg)	BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ATAXIA	Shinryo to Shinyaku. Medical Consultation and New Remedies. Vol. 11, Pg. 2533, 1974.
mouse	LD50	oral	1540mg/kg (1540mg/kg)		Arzneimittel-Forschung. Drug Research. Vol. 19, Pg. 615, 1969.
mouse	LD50	subcutaneous	145mg/kg (145mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD	Shinryo to Shinyaku. Medical Consultation and New Remedies. Vol. 11, Pg. 2533, 1974.
rat	LD50	intraperitoneal	180mg/kg (180mg/kg)	BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ATAXIA	Shinryo to Shinyaku. Medical Consultation and New Remedies. Vol. 11, Pg. 2533, 1974.
rat	LD50	oral	6380mg/kg (6380mg/kg)		Arzneimittel-Forschung. Drug Research. Vol. 19, Pg. 615, 1969.
rat	LD50	subcutaneous	520mg/kg (520mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD	Shinryo to Shinyaku. Medical Consultation and New Remedies. Vol. 11, Pg. 2533, 1974.