AG003JI7

498-60-2 | Furan-3-carbaldehyde

AG003JI7

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CAS Number	498-60-2
Catalog Number	AG003JI7(AGN-PC-0JK9II)
Chemical Name	Furan-3-carbaldehyde
IUPAC Name	furan-3-carbaldehyde
InChI	InChI=1S/C5H4O2/c6-3-5-1-2-7-4-5/h1-4H
InChI Key	AZVSIHIBYRHSLB-UHFFFAOYSA-N
MDL Number	MFCD00010424
Molecular Formula	C5H4O2
Molecular Weight	96.0841
SMILES	O=CC1=COC=C1
UNII	POB632X444
Synonyms	3-Furaldehyde, furan-3-carbaldehyde, 498-60-2, 3-Furancarboxaldehyde, Furan-3-carboxaldehyde, 3-Formylfuran, 3-furfural, UNII-POB632X444, MFCD00010424, CHEBI:87609, AZVSIHIBYRHSLB-UHFFFAOYSA-N, POB632X444, 3-Furancarboxaldehyde, >=97%, 3-Furaldehyde, 98%, stabilized, 3furaldehyde, 3-furancarbaldehyde, PubChem6948, ACMC-209kip, AC1Q6PYG, AC1L1V0K, AC1Q6Q9P, AMOT0244, CHEMBL2228160, CTK1D7099, DTXSID40198076, CS-M0782, KS-000010JV, ZINC2040441, ANW-30863, GEO-01440, SBB004385, AKOS000289061, AM85794, RTR-017889, TRA0088950, AJ-33230, AN-45336, BP-20266, CJ-32381, SC-04839, AB0064381, AB1003254, DB-002732, TR-017889, F0354, FT-0615760, K-9250, 97525-EP2284157A1, 97525-EP2305679A1, 130840-EP2281812A1, 130840-EP2295433A2, I14-0265, W-202882, F2191-0143, InChI=1/C5H4O2/c6-3-5-1-2-7-4-5/h1-4, C5-H4-O2, CID10351, AR-1F3293, 3-Furaldehyde, 97%, stabilized 5g, 51867-83-5,

Complexity	70.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	96.021g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	96.085g/mol
Monoisotopic Mass	96.021g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H226-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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