CAS No.3164-29-2,Ammonium L-tartrate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	3164-29-2
Name:	Ammonium L-tartrate
Article Data:	2

Formula:	C₄H₁₂O₆N₂
Molecular Weight:	184.149
Synonyms:	Ammoniumtartrate ((NH4)2O6C4H4) (6CI,7CI);Butanedioic acid, 2,3-dihydroxy- (2R,3R)-,diammonium salt (9CI);Butanedioic acid, 2,3-dihydroxy- [R-(R,R)]-,diammonium salt;Tartaric acid, diammonium salt (8CI);Ammonium d-tartrate;Ammonium tartrate;Diammonium L-(+)-tartrate;Diammonium d-tartrate;Diammoniumtartrate;L-Tartaric acid ammonium salt;
EINECS:	221-618-9
Density:	1.601 g/mL at 25 °C(lit.)
Melting Point:	decomposes [CRC10]
Boiling Point:	399.3 °C at 760 mmHg
Flash Point:	209.4 °C
Solubility:	63 g/L (15 °C) in water
Appearance:	white crystalline powder
Hazard Symbols:	Xn
Risk Codes:	20/21/22-36/37/38
Safety:	24/25-36-26
PSA:	120.72000
LogP:	-4.03960

Synthetic route

: (1S,4R)-4-aminocyclopent-2-ene-1-carboxylic acid methyl ester tartrate

A: 138923-03-2
(1S,4R)-(-)-methyl-4-aminocyclopent-2-en-1-carboxylate hydrochloride

B: 3164-29-2
diammonium tartate

Conditions

Conditions	Yield
With ammonia In methanol; water at 20℃; for 1h; Product distribution / selectivity;

: (1R,2R)-2-hydroxy-1-(methylamino)-1,2,3,4-tetrahydronaphthalene L-(+)-tartrate salt

A: 169106-10-9
(+)-(1R,2R)-trans-1,2,3,4-tetrahydro-1-(methylamino)2-naphthalenol

B: 3164-29-2
diammonium tartate

Conditions

Conditions	Yield
With ammonium hydroxide; sodium chloride In tert-butyl methyl ether; water pH=> 8;

: 3164-29-2
diammonium tartate

: (2S,3S)-5-Methoxy-3-methyl-2-pentyl-3,4-dihydro-2H-pyrrole

: (4R,5R)-4-Methyl-5-pentyl-pyrrolidin-2-ylideneamine; compound with 2,3-dihydroxy-succinic acid

Conditions

Conditions	Yield
In methanol for 5h; Heating;

: 142-81-4
1-hexylamine hydrochloride

: 3164-29-2
diammonium tartate

: 411235-31-9
(R,R)-(+)-di-N,N'-hexyltartramide

Conditions

Conditions	Yield
at 20 - 180℃; for 0.416667h; microwave irradiation;

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Consensus Reports

Reported in EPA TSCA Inventory.

Specification

The Diammonium tartrate, with the CAS registry number 3164-29-2 and EINECS registry number 221-618-9, has the systematic name of (2R,3R)-2,3-dihydroxybutanedioic acid diammoniate. And the molecular formula of this chemical is C₄H₁₂O₆N₂. It is a kind of white crystalline powder, and belongs to the product category of Industrial/Fine Chemicals.

The physical properties of Diammonium tartrate are as following: (1)ACD/LogP: -1.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.86; (4)ACD/LogD (pH 7.4): -6.18; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 71.06 Å²; (13)Flash Point: 209.4 °C; (14)Enthalpy of Vaporization: 75.13 kJ/mol; (15)Boiling Point: 399.3 °C at 760 mmHg; (16)Vapour Pressure: 4.93E-08 mmHg at 25°C.

Preparation and uses of Diammonium tartrate: Pass ammonia gas to ethanol solution which tartaric acid is dissolved. And it will give amorphous powdered precipitation. Filter and wash with ethanol and aether, then you can get the product after drying. In addition, it can be used as intermediate for analytical reagent and organic synthesis. And it is also used in pharmaceuticals industry.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin, and it is also Harmful by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; Avoid contact with skin and eyes; Avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@H](O)[C@@H](O)C(=O)O.N.N
(2)InChI: InChI=1/C4H6O6.2H3N/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);2*1H3/t1-,2-;;/m1../s1
(3)InChIKey: NGPGDYLVALNKEG-OLXYHTOABR

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rabbit	LD50	intravenous	113mg/kg (113mg/kg)		"Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
rabbit	LD50	subcutaneous	1130mg/kg (1130mg/kg)		"Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.