ethyl 2-methyl-1H-pyrrole-3-carboxylate

ethyl 2-methyl-1H-pyrrole-3-carboxylate

CAS: 936-12-9

Formula: C8H11NO2

SMILES: CCOC(=O)C1=C(C)NC=C1

IUPAC: ethyl 2-methyl-1H-pyrrole-3-carboxylate

InChI: InChI=1S/C8H11NO2/c1-3-11-8(10)7-4-5-9-6(7)2/h4-5,9H,3H2,1-2H3

Composition: C (62.73%), H (7.24%), N (9.14%), O (20.89%)

Molar Mass: 153.181

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	153.078978598
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	DJDPDVJJTIGJTE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.74
Topological Polar Surface Area	42.09
Polarizability	16.08
Ring Count	1
Rotatable Bond Count	3

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