Text Search
Structure Search

ethyl 5-methyl-1H-pyrrole-3-carboxylate

ethyl 5-methyl-1H-pyrrole-3-carboxylate

CAS: 2199-50-0

Formula: C8H11NO2

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

IUPAC: ethyl 5-methyl-1H-pyrrole-3-carboxylate

InChI: InChI=1S/C8H11NO2/c1-3-11-8(10)7-4-6(2)9-5-7/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 KCDURADJPCIWEU-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

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 2199-50-0 $38.30-$1,080.54$38.30$73.49$229.77$967.73$1,080.54
Request Quote