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80-70-6

Basic Information
CAS No.: 80-70-6
Name: 1,1,3,3-Tetramethylguanidine
Article Data: 15
Cas Database
Molecular Structure:
Molecular Structure of 80-70-6 (1,1,3,3-Tetramethylguanidine)
Formula: C5H13N3
Molecular Weight: 115.178
Synonyms: Guanidine,1,1,3,3-tetramethyl- (6CI,8CI);1,1,3,3-Tetramethylguanidine;
EINECS: 201-302-7
Density: 0.9 g/cm3
Melting Point: -30 °C
Boiling Point: 163.2 °C at 760 mmHg
Flash Point: 60 °C
Solubility: miscible with water
Appearance: liquid
Hazard Symbols:
Risk Codes: 22-34-20/22-10
Safety: 26-27-36/37/39-45-16
Transport Information: UN 2920 8/PG 2
PSA: 30.33000
LogP: 0.14410
Synthetic route
506-78-5

cyanogen iodide

124-40-3

dimethyl amine

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
With diethyl ether
126661-09-4

1-Nitro-4-nitromethyl-benzene; compound with N,N,N',N'-tetramethyl-guanidine

A

1610-26-0

1-nitro-4-(nitromethyl)benzene

B

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
In 1,3,5-trimethyl-benzene at 30℃; Equilibrium constant; Irradiation; other solvents;

1-Ethoxy-2,2-bis-(4-nitro-phenyl)-ethenol; compound with N,N,N',N'-tetramethyl-guanidine

A

40748-64-9

ethyl bis-(4-nitrophenyl)acetate

B

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
In tetrahydrofuran at 10.3 - 34.8℃; Kinetics; Equilibrium constant;
methyl iodide compound of tetramethylthiourea

methyl iodide compound of tetramethylthiourea

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
With ethanol; ammonia at 100℃;
pentamethylisothiuronium-iodide

pentamethylisothiuronium-iodide

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
With ammonia; water
124-40-3

dimethyl amine

S.N.N-trimethyl-isothiourea

S.N.N-trimethyl-isothiourea

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
With ethanol; mercury dichloride
1467-79-4

NCNMe2

124-40-3

dimethyl amine

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
With N,N-dimethylammonium chloride at 100℃; for 12h;
325774-15-0

1,1,3,3-tetramethylgyanidine-gallane (1/1)

A

7440-55-3

gallium

B

1333-74-0

hydrogen

C

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
at 85 - 90℃; Thermodynamic data;

C2H5FO*C5H13N3

A

371-62-0

2-fluoroethanol

B

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
In octanol at 24.84℃; Equilibrium constant;

C4H4F6O*C5H13N3

A

1515-14-6

1,1,1,3,3,3-hexafluoro-2-methylpropan-2-ol

B

80-70-6

N,N,N',N'-tetramethylguanidine

Conditions
ConditionsYield
In octanol at 24.84℃; Equilibrium constant;
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Chemistry

Molecular formula: C5H13N3
Molecular Weight: 115.18 g/mol
Molecular Structure of Tetramethylguanidine (CAS NO.80-70-6):
 
EINECS: 201-302-7
Appearance: liquid
Melting Point: -30 °C 
Boiling Point: 163.2 °C at 760 mmHg
Flash Point: 60 °C 
Density: 0.918 g/mL at 25 °C(lit.)
Storage Temp.: 2-8 °C
Water Solubility: miscible
Index of Refraction: 1.455
Molar Refractivity: 34.66 cm3
Molar Volume: 127.5 cm3
Surface Tension: 27.7 dyne/cm
XLogP3: 0.4
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 2
Exact Mass: 115.110947
MonoIsotopic Mass: 115.110947
Topological Polar Surface Area: 30.3
Heavy Atom Count: 8 
Canonical SMILES: CN(C)C(=N)N(C)C
InChI: InChI=1S/C5H13N3/c1-7(2)5(6)8(3)4/h6H,1-4H3
InChIKey: KYVBNYUBXIEUFW-UHFFFAOYSA-N
EINECS: 201-302-7
Product Categories: Various hydrocyanic acid derivatives; Hydrocyanic acid derivatives

Uses

 Tetramethylguanidine (80-70-6) is used as as accelerator for the syntheses of polysulfured rubber, polyurethane foam catalyst, as a strong base in the photochemical (e.g. couplers) and in the pharmaceutical (e.g. steroids) industries.

Safety Profile

Hazard Codes: CorrosiveC
Risk Statements: 22-34-20/22-10 
R22:Harmful if swallowed. 
R34:Causes burns. 
R20/22:Harmful by inhalation and if swallowed. 
R10:Flammable.
Safety Statements: 26-27-36/37/39-45-16 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S27:Take off immediately all contaminated clothing. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S16:Keep away from sources of ignition.
RIDADR: UN 2920 8/PG 2
WGK Germany: 1
F: 9-23
Hazard Note: Harmful/Corrosive
HazardClass: 8
PackingGroup: II
HS Code: 29252000

Specification

 Tetramethylguanidine (CAS NO.80-70-6) is also named as AI3-51030 ; CCRIS 6689 ; N,N,N',N'-Tetramethylguanidine ; NSC 148309 ; Guanidine, 1,1,3,3-tetramethyl- (8CI) ; Guanidine, N,N,N',N'-tetramethyl- . Tetramethylguanidine (CAS NO.80-70-6) is a strong amine base with a higher pKa than typical amines. It is highly water soluble so easily removed from other chemicals in a chemical process.

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