1,4,7-Trimethyldiethylenetriamine

HCID 66930CAS 105-84-0
Substructure searchFind similar structures

Basic information

Standard SMILES
CNCCN(C)CCNC
InChIKey
ODZZIKZQNODXFS-UHFFFAOYSA-N
Molecular formula
C7H19N3
Average molar mass
145.25 g/mol
Monoisotopic mass
145.15789761

Names & identifiers

Preferred name
1,4,7-Trimethyldiethylenetriamine
IUPAC
N,N'-dimethyl-N'-[2-(methylamino)ethyl]ethane-1,2-diamine
English name
N,N'-dimethyl-N-[2-(methylamino)ethyl]ethylenediamine
Molecular formula
C7H19N3
Molecular weight
145.25

Names & synonyms

105-84-01,4,7-TrimethyldiethylenetriamineN,N',N''-TrimethyldiethylenetriamineN,N'-dimethyl-N-[2-(methylamino)ethyl]ethylenediamineAWI0Y8Y9OP1,2-Ethanediamine, N,N'-dimethyl-N-[2-(methylamino)ethyl]-Diethylenetriamine, 1,4,7-trimethyl-UNII-AWI0Y8Y9OPEINECS 203-337-31,2-Ethanediamine, N1,N2-dimethyl-N1-(2-(methylamino)ethyl)-NSC 166321NSC-166321
Show more names
N,N'-dimethyl-N-[2-(Methylbis[2-(methylamino)ethyl]amineN，N'，N''-Trimethyldiethylenetriamine1,4,7-Trimethyldiethylenetriamine,97%N,N',N''-Trimethyldiethylenetriamine >N,N-Bis[2-(methylamino)ethyl]methylamine2,2'-(Methylimino)bis(N-methylethanamine)2,2'-Bis(methylamino)-N-methyldiethylamine
DTXSID00593261,2-Ethanediamine, N,N'-dimethyl-N-(2-(methylamino)ethyl)-N,N'-Dimethyl-N-(2-(methylamino)ethyl)ethylenediamineN1,N2-Dimethyl-N1-[2-(methylamino)ethyl]-1,2-ethanediamineN,N'-DIMETHYL-N-(2-(METHYLAMINO)ETHYL)-1,2-ETHANEDIAMINE1,4,7-TRIMETHYL-1,4,7-TRIAZAHEPTANEN1,N2-DIMETHYL-N1-(2-(METHYLAMINO)ETHYL)-1,2-ETHANEDIAMINE1,2-Ethanediamine, N1,N2-dimethyl-N1-[2-(methylamino)ethyl]-

Database identifiers

CAS
105-84-0
PubChem CID
66930
DTXSID
DTXSID0059326
UNII
AWI0Y8Y9OP
EC Number
203-337-3
Nikkaji
J26.194G

Properties

Computed structural properties

XLogP
-0.4
Topological polar surface area
27.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
10

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
Physical DescriptionLiquid; [Sigma-Aldrich MSDS]

Physicochemical properties

Boiling point
56 °C/0.1mmHg · 56°C/0.1mmHg(lit.)
Density
0.9135 · 0.9135 (estimate)
refractive index
1.45 to · 1.4500 to 1.4540
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
pka
10.41 · 10.41±0.10(Predicted)
form
Liquid

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazards SummaryAn irritant; Harmful by ingestion; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (97.5%)

Safety data

tsca
TSCA listed
ridadr
UN 2735 8/PG II
hs_code
2921.29.0055
Signal word
Danger
Symbol(GHS)
GHS07
hazard_class
8

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,2-Ethanediamine, N1,N2-dimethyl-N1-[2-(methylamino)ethyl]-: ACTIVE

Upstream & downstream products

Suppliers45 total

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]

Related reactions

1 records
New reaction record

Linked notes

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