ethyl 5-formyl-1H-pyrrole-2-carboxylate

ethyl 5-formyl-1H-pyrrole-2-carboxylate

CAS: 7126-50-3

Formula: C8H9NO3

SMILES: CCOC(=O)C1=CC=C(N1)C=O

IUPAC: ethyl 5-formyl-1H-pyrrole-2-carboxylate

InChI: InChI=1S/C8H9NO3/c1-2-12-8(11)7-4-3-6(5-10)9-7/h3-5,9H,2H2,1H3

Composition: C (57.48%), H (5.43%), N (8.38%), O (28.71%)

Molar Mass: 167.164

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	167.058243154
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HTPFMOGFQKDFHX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.93
Topological Polar Surface Area	59.16
Polarizability	16.25
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99.52%	<7 Days	7126-50-3		$19.64-$354.37$19.64$72.00$143.06$354.37

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