(2-Amino-2-methylpropyl)dimethylamine

HCID 226843

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Basic information

CAS: 89379-40-8
Standard SMILES: CN(C)CC(C)(C)N
InChIKey: IRNAEDHJBNPCEZ-UHFFFAOYSA-N
Molecular formula: C6H16N2
Average molar mass: 116.2 g/mol
Monoisotopic mass: 116.13134852

Names & identifiers

Preferred name: (2-Amino-2-methylpropyl)dimethylamine
IUPAC: 1-N,1-N,2-trimethylpropane-1,2-diamine
English name: 1-Dimethylamino-2-methyl-2-aminopropane
Molecular formula: C6H16N2
Molecular weight: 116.2

Names & synonyms

(2-amino-2-methylpropyl)dimethylamineRefChem:395275817-832-289379-40-81-Dimethylamino-2-methyl-2-aminopropaneMFCD00269646N1,N1,2-trimethylpropane-1,2-diamine1-N,1-N,2-trimethylpropane-1,2-diamine1,2-Propanediamine, N1,N1,2-trimethyl-1,2-propanediamine, N~1~,N~1~,2-trimethyl-, hydrochlorideNSC17718SCHEMBL862199

Show more names

TIMTEC-BB SBB008492N1,N1,2,2-Tetramethylethylenediamine(2-amino-2-methyl-propyl)-dimethyl-amineN1,N1-dimethyl-2-methyl-1,2-propanediamine1,2-propanediamine, N~1~,N~1~,2-trimethyl-N~1~,N~1~,2-trimethylpropane-1,2-diamine hydrochloride(2-amino-2-methylpropyl)dimethylamine(SALTDATA: 2.05HCl 0.2H2O)

SCHEMBL3137486SCHEMBL27509476DTXSID50280633IRNAEDHJBNPCEZ-UHFFFAOYSA-NALBB-012390N',N', 2-TrimethylpropylenediamineN,N,2-trimethylpropane-1,2-diamineNSC-17718

Database identifiers

CAS: 89379-40-8
PubChem CID: 226843
DTXSID: DTXSID50280633
EC Number: 817-832-2
Nikkaji: J3.770.462H

Properties

Computed structural properties

XLogP: -0.1
Topological polar surface area: 29.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 8
Formal charge: 0
Complexity: 66

Physicochemical properties

Boiling point: 119 °C · 119 °C(Press: 755 Torr)
Density: 0.7882 g/cm3 · 0.7882 g/cm3
pka: 10.43 · 10.43±0.28(Predicted)
Symbol(GHS): 2 · GHS02,GHS05
Signal word: Danger
Hazard statements: 226 · H226-H314
Precautionary statements: 210 · P210-P241-P260
Risk Statements: 34 · 34
Safety Statements: 26 · 26-36/37/39
RIDADR: 2735 · 2735
HazardClass: IRRITANT
HS Code: 2921290090 · 2921290090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)；Skin Corr. 1B (100%)

Safety data

ridadr: 2735
hs_code: 2921290090
risk_code: 34
Signal word: Danger
Symbol(GHS): GHS02,GHS05
safety_code: 26-36/37/39
hazard_class: IRRITANT
Hazard statements: H226-H314
Precautionary statements: P210-P241-P260

Chemistry & industry

Applications

Uses(2-Amino-2-methylpropyl)dimethylamine is used as a reactant in the preparation and structure activity relationships of angular benzophenazine dual topoisomerase I and topoisomerase II inhibitors as anticancer agents.