2-Aminomethyl-1-ethylpyrrolidine

HCID 117295CAS 26116-12-1
Substructure searchFind similar structures

Basic information

Standard SMILES
CCN1CCCC1CN
InChIKey
UNRBEYYLYRXYCG-UHFFFAOYSA-N
Molecular formula
C7H16N2
Average molar mass
128.22 g/mol
Monoisotopic mass
128.13134851

Overview

structure in first source

Names & identifiers

Preferred name
2-Aminomethyl-1-ethylpyrrolidine
IUPAC
(1-ethylpyrrolidin-2-yl)methanamine
English name
2-(Aminomethyl)-1-ethylpyrrolidine
Molecular formula
C7H16N2
Molecular weight
128.22

Names & synonyms

2-Aminomethyl-1-ethylpyrrolidineRefChem:757822-A-1-EP2-(Aminomethyl)-1-ethylpyrrolidine26116-12-1(1-ethylpyrrolidin-2-yl)methanamine2-Pyrrolidinemethanamine, 1-ethyl-1-Ethylpyrrolidin-2-ylmethylamineMFCD00003178n-ethyl-2-aminomethylpyrrolidine1-(1-ethylpyrrolidin-2-yl)methanamine(1-ethylpyrrolidin-2-yl)methylamine
Show more names
Sulpiride impurity A CRSAmisulpride EP Impurity An-ethyl-2-methylaminopyrrolidine)-1-ethyLRefer to S-402Sulpiride EP Impurity ASulpiride Impurity A(EP)1-Ethyl-2-pyrrolidinemethylamine
DTXSID30576982-(Aminomethyl)-N-ethylpyrrolidineSULPIRIDE IMPURITY APyrrolidine, 2-(aminomethyl)-1-ethyl-K2U95PPN4Z1-ethyl-2-pyrrolidinemethanamine1-Ethyl-2-(aminomethyl)pyrrolidineN-Ethyl-2-(aminomethyl)pyrrolidine

Database identifiers

CAS
26116-12-1
PubChem CID
117295
DTXSID
DTXSID3057698
ChEMBL
CHEMBL3183533
UNII
K2U95PPN4Z
EC Number
247-466-3
Nikkaji
J38.398H

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
29.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
9

Physicochemical properties

Boiling point
58 · 58-60 °C16 mm Hg(lit.)
Density
0.884 g/mL · 0.884 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.4670(lit.)
Flash point
135 °F · 135 °F
storage temp.
2 · 2-8°C
solubility
Chloroform (Sparingly), Methanol (Sparingly)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H226 (96.6%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 59 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 21-06-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/5638
Hazard Classes and CategoriesFlam. Liq. 3 (96.6%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 1993 3/PG 3
hs_code
29339900
risk_code
36/37/38-20/21/22
Signal word
Warning

Chemistry & industry

Applications

Uses2-(Aminomethyl)-1-ethylpyrrolidine is used as a reagent in the synthesis of S-Desethyl S-Methyl Amisulpride (D289595)

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

Related reactions

258 records
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Linked notes

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