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3-{[(furan-2-ylmethyl)sulfanyl]methyl}-4-methoxybenzaldehyde

3-{[(furan-2-ylmethyl)sulfanyl]methyl}-4-methoxybenzaldehyde

CAS: 438531-40-9

Formula: C14H14O3S

SMILES: COC1=C(CSCC2=CC=CO2)C=C(C=O)C=C1

IUPAC: 3-({[(furan-2-yl)methyl]sulfanyl}methyl)-4-methoxybenzaldehyde

InChI: InChI=1S/C14H14O3S/c1-16-14-5-4-11(8-15)7-12(14)9-18-10-13-3-2-6-17-13/h2-8H,9-10H2,1H3

Composition: C (64.10%), H (5.38%), O (18.30%), S (12.22%)

Molar Mass: 262.32

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 262.066365485
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey OUUNDDNGUOPFBR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.81
Topological Polar Surface Area 39.44
Polarizability 27.94
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 438531-40-9 $134.76$134.76
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