CAS 1121-46-6 2-(Furan-2-yl)ethan-1-amine (HCID 1132863)

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Basic information

CAS: 1121-46-6
Standard SMILES: NCCc1ccco1
InChIKey: ZQSLNSHMUQXSQJ-UHFFFAOYSA-N
Molecular formula: C6H9NO
Average molar mass: 111.14 g/mol
Monoisotopic mass: 111.06841391

Names & identifiers

Preferred name: 2-(Furan-2-yl)ethan-1-amine
IUPAC: 2-(furan-2-yl)ethanamine
English name: 2-FURAN-2-YL-ETHYLAMINE
Molecular formula: C6H9NO
Molecular weight: 111.14

Names & synonyms

2-Furanethanamine2-(furan-2-yl)ethan-1-amineRefChem:460992601-166-21121-46-62-Furan-2-yl-ethylamine2-(furan-2-yl)ethanamine2-Furan-2-ylethylamine2-(2-furyl)ethanamine2-aminoethylfuran2-(2-aminoethyl)furanMFCD04113973

Show more names

2-(2-furyl)ethanamine(SALTDATA: FREE)

2-(2-furyl)ethylamine2-(2-Furyl)ethylamine; 2-(Furan-2-yl)ethanamine; 2-Furylethylamine; [2-(Furan-2-yl)ethyl]aminefurylethylamine2-furylethylaminefurfurylmethylamine2-(2-Aminoethyl)furane2-(2-amino-ethyl)furan2-(2-aminoethyl)-furan

Database identifiers

CAS: 1121-46-6
PubChem CID: 1132863
DTXSID: DTXSID60360632
ChEMBL: CHEMBL4552984
EC Number: 601-166-2
Nikkaji: J2.321.481D

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 39.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 8
Formal charge: 0
Complexity: 65.5

Physicochemical properties

Melting point: 204 °C · 204 °C
Boiling point: 59 · 59-60 °C(Press: 25 Torr)
Density: 0.992 g/cm3 · 0.992 g/cm3(Temp: 25 °C)
storage temp.: 2 · 2-8°C, protect from light
form: liquid
pka: 9.59 · 9.59±0.10(Predicted)
color: Colourless
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H317
Precautionary statements: 501 · P501-P261-P272-P270-P264-P280-P302+P352-P362+P364-P333+P313-P301+P312+P330
HazardClass: IRRITANT
HS Code: 2932190090 · 2932190090

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H226 (33.3%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, 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 3 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 CategoriesFlam. Liq. 3 (33.3%)

Safety data

hs_code: 2932190090
Signal word: Warning
Symbol(GHS): GHS07
hazard_class: IRRITANT
Hazard statements: H302-H317
Precautionary statements: P501-P261-P272-P270-P264-P280-P302+P352-P362+P364-P333+P313-P301+P312+P330