1,3-dimethyl 5-[(2E)-3-(5-methylfuran-2-yl)prop-2-enamido]benzene-1,3-dicarboxylate

1,3-dimethyl 5-[(2E)-3-(5-methylfuran-2-yl)prop-2-enamido]benzene-1,3-dicarboxylate

Formula: C18H17NO6

SMILES: COC(=O)C1=CC(=CC(NC(=O)C=CC2=CC=C(C)O2)=C1)C(=O)OC

IUPAC: 1,3-dimethyl 5-[(2E)-3-(5-methylfuran-2-yl)prop-2-enamido]benzene-1,3-dicarboxylate

InChI: InChI=1S/C18H17NO6/c1-11-4-5-15(25-11)6-7-16(20)19-14-9-12(17(21)23-2)8-13(10-14)18(22)24-3/h4-10H,1-3H3,(H,19,20)/b7-6+

Composition: C (62.97%), H (4.99%), N (4.08%), O (27.96%)

Molar Mass: 343.335

Atom Count: 42

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	343.105587271
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XNGMCNDEKCNYFY-VOTSOKGWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.93
Topological Polar Surface Area	94.84
Polarizability	33.94
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H17NO6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00