ethyl 4-ethyl-3-methyl-1H-pyrrole-2-carboxylate

ethyl 4-ethyl-3-methyl-1H-pyrrole-2-carboxylate

CAS: 4391-98-4

Formula: C10H15NO2

SMILES: CCOC(=O)C1=C(C)C(CC)=CN1

IUPAC: ethyl 4-ethyl-3-methyl-1H-pyrrole-2-carboxylate

InChI: InChI=1S/C10H15NO2/c1-4-8-6-11-9(7(8)3)10(12)13-5-2/h6,11H,4-5H2,1-3H3

Composition: C (66.27%), H (8.34%), N (7.73%), O (17.66%)

Molar Mass: 181.235

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	181.110278727
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	VRVOLGXNSYCRON-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.15
Topological Polar Surface Area	42.09
Polarizability	19.67
Ring Count	1
Rotatable Bond Count	4

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