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4-(hydroxymethyl)furan-2-carbaldehyde

4-(hydroxymethyl)furan-2-carbaldehyde

CAS: 158360-01-1

Formula: C6H6O3

SMILES: OCC1=COC(C=O)=C1

IUPAC: 4-(hydroxymethyl)furan-2-carbaldehyde

InChI: InChI=1S/C6H6O3/c7-2-5-1-6(3-8)9-4-5/h1,3-4,7H,2H2

Composition: C (57.14%), H (4.80%), O (38.06%)

Molar Mass: 126.111

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 126.031694053
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GYQBROOJXNICMZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 31.85
Topological Polar Surface Area 50.44
Polarizability 11.63
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 158360-01-1 $502.55$502.55
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