3-(Aminomethyl)furan - CAS 4543-47-9

Catalog:	BB025864
Product Name:	3-(Aminomethyl)furan
CAS:	4543-47-9
Synonyms:	3-furanylmethanamine; furan-3-ylmethanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	furan-3-ylmethanamine
Description:	3-(Aminomethyl)furan (CAS# 4543-47-9) is a useful research chemical.
Molecular Weight:	97.12
Molecular Formula:	C5H7NO
Canonical SMILES:	C1=COC=C1CN
InChI:	InChI=1S/C5H7NO/c6-3-5-1-2-7-4-5/h1-2,4H,3,6H2
InChI Key:	XNABHFLZYMCJHE-UHFFFAOYSA-N
Boiling Point:	52-54 °C / 15 mmHg
Density:	1.053 g/cm³
Appearance:	Pale-yellow to yellow-brown liquid
LogP:	1.43860

Publication Number	Title	Priority Date
US-2021262014-A1	Nanostructure, a biosensor including the nanostructure, and a screening method	20200226
WO-2021050700-A1	Cyclooxygenase-2 inhibitors and uses thereof	20190913
WO-2021005586-A1	Tricyclic akr1c3 dependent kars inhibitors	20190801
WO-2020257940-A1	Furosemide analogues and compositions and uses thereof for treatment of alzheimer's disease	20190626
CN-109851594-B	Method for synthesizing 3-aminomethyl tetrahydrofuran by taking furan as raw material	20190319

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Related Functional Groups

Amines and Anilines

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GHS Hazard Statement:	H301 (92.86%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P310, P305+P351+P338, P321, P330, P337+P313, P405, and P501
Signal Word:	Danger

Complexity:	56
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	97.052763847
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	97.052763847
Rotatable Bond Count:	1
Topological Polar Surface Area:	39.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0