2-Propen-1-amine, N-ethyl-2-methyl-

HCID 87587CAS 18328-90-0

Basic information

Standard SMILES
C=C(C)CNCC
InChIKey
AXTLFVLHXSDZOW-UHFFFAOYSA-N
Molecular formula
C6H13N
Average molar mass
99.17 g/mol
Monoisotopic mass
99.10479942

Names & identifiers

Preferred name
2-Propen-1-amine, N-ethyl-2-methyl-
IUPAC
N-ethyl-2-methylprop-2-en-1-amine
English name
N-Ethylmethallylamine
Molecular formula
C6H13N
Molecular weight
99.17

Names & synonyms

N-Ethyl-2-methylallylamine18328-90-0N-Ethylmethallylamine2-Propen-1-amine, N-ethyl-2-methyl-N-Ethyl-2-methyl-2-propen-1-amineN-Ethyl methallylamineN-EthylmethylallylamineDTXSID3027798UNII-DQF79T13KFEINECS 242-217-5DQF79T13KFDTXCID007798
Show more names
N-Ethylmethallylaminn-ethvlmethallvlamineN-ethylmethacrylamineEthyl 2-methylallylaminen-ethyl-2-methyl-allylamin
EC 242-217-5RefChem:89193Allylamine, N-ethyl-2-methyl-(6CI,8CI)242-217-5AXTLFVLHXSDZOW-UHFFFAOYSA-NN-ethyl-2-methylprop-2-en-1-amineMFCD00010757N-2-methylallyl-N-ethylamine

Database identifiers

CAS
18328-90-0
PubChem CID
87587
DTXSID
DTXSID3027798
ChEMBL
CHEMBL3187873
UNII
DQF79T13KF
EC Number
242-217-5
Nikkaji
J266.124A

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
12 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
7

Experimental & physicochemical properties

Physical DescriptionLiquid
Collision Cross Section123.0 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID3027798]

Physicochemical properties

Boiling point
104.5 · 104.5-105 °C(lit.)
Density
0.753 g/mL · 0.753 g/mL at 25 °C(lit.)
vapor pressure
13.332 hPa · 13.332hPa at 20℃
refractive index
20 · n20/D 1.4221(lit.)
Flash point
45 °F · 45 °F
storage temp.
2 · 2-8°C, protect from light

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 11.1% (5 of 45) of reports.

Danger

H225 (88.9%): Highly Flammable liquid and vapor [Danger Flammable liquids]

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

Aggregated GHS information provided per 45 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 3 items

2-Propen-1-amine, N-ethyl-2-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propen-1-amine, N-ethyl-2-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 29-06-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/11358

2-Propen-1-amine, N-ethyl-2-methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesFlam. Liq. 2 (88.9%)

Safety data

wgk
2
tsca
TSCA listed
ridadr
UN 2733 3/PG 2
hs_code
29211990
risk_code
11-20/21/22-34
Signal word
Danger

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 250,000 - <550,000 lb
Consumer UsesIntermediate
Industry UsesSurfactant (surface active agent)
General Manufacturing Information · 2 items

All Other Basic Organic Chemical Manufacturing

2-Propen-1-amine, N-ethyl-2-methyl-: ACTIVE

Applications

UsesN-Ethylmethallylamine is an intermediate in synthesizing Ethalfluralin (E917718), a herbicide.

Upstream & downstream products

Suppliers39 total

湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
Aladdin Scientific[email protected]

Related reactions

10 records

Linked notes

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