N-(2-Dimethylaminoethyl)-N-methylformamide

HCID 279482

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Basic information

CAS: 105669-53-2
Standard SMILES: CN(C)CCN(C)C=O
InChIKey: CSLBJRKWKVBRSQ-UHFFFAOYSA-N
Molecular formula: C6H14N2O
Average molar mass: 130.19 g/mol
Monoisotopic mass: 130.11061307

Names & identifiers

Preferred name: N-(2-Dimethylaminoethyl)-N-methylformamide
IUPAC: N-[2-(dimethylamino)ethyl]-N-methylformamide
English name: N-(2-Dimethylaminoethyl)-N-methylformam&
Molecular formula: C6H14N2O
Molecular weight: 130.19

Names & synonyms

105669-53-2N-(2-Dimethylaminoethyl)-N-methylformamideDTXSID50299402RefChem:360671DTXCID10250539626-391-3N-[2-(Dimethylamino)ethyl]-N-methylformamideN-(2-(Dimethylamino)ethyl)-N-methylformamideMFCD04039895N-Formyl-N,N',N'-trimethylethylenediamineNSC130067N-(2-(Dimethylamino)

Show more names

Formamide, N-[2-(dimethylamino)ethyl]-N-methyl-N-[2-(Dimethylamino)ethyl]-N-methylformamide>N-[2-(Dimethylamino)ethyl]-N-methylformamide

N-(2-DIMETHYLAMINOETHYL)-N-METHYLFORMAMN-(2-DIMETHYLAMINOETHYL)-N-METHYLFORMAM&SCHEMBL616499SCHEMBL944401AKOS013153476NSC-130067N,N'-trimethyl-N-formyl-ethylenediamineAS-37589

Database identifiers

CAS: 105669-53-2
PubChem CID: 279482
DTXSID: DTXSID50299402
EC Number: 626-391-3
Nikkaji: J613.842J

Properties

Computed structural properties

XLogP: -0.2
Topological polar surface area: 23.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 9
Formal charge: 0
Complexity: 83.1

Physicochemical properties

Boiling point: 218 · 218-219 °C(lit.)
Density: 0.936 g/mL · 0.936 g/mL at 25 °C(lit.)
refractive index: 20 · n20/D 1.4570(lit.)
Flash point: 159 °F · 159 °F
storage temp.: 2 · 2-8°C
form: clear liquid
color: Colorless to Yellow
InChI: 1S/C6H14N2O/c1-7(2)4-5-8(3)6-9/h6H,4-5H2,1-3H3
InChIKey: CSLBJRKWKVBRSQ-UHFFFAOYSA-N
SMILES: [H]C(=O)N(C)CCN(C)C
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
HS Code: 2924.19 · 2924.19.8000
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
hs_code: 2924.19.8000
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications

UsesN-(2-Dimethylaminoethyl)-N-methylformamide is a pyridoneamide derivative that is used as a focal adhesion kinase inhibitors and their use for the treatment of cancer.