Text Search
Structure Search

methyl 4-tert-butyl-1H-pyrrole-3-carboxylate

methyl 4-tert-butyl-1H-pyrrole-3-carboxylate

Formula: C10H15NO2

SMILES: COC(=O)C1=CNC=C1C(C)(C)C

IUPAC: methyl 4-tert-butyl-1H-pyrrole-3-carboxylate

InChI: InChI=1S/C10H15NO2/c1-10(2,3)8-6-11-5-7(8)9(12)13-4/h5-6,11H,1-4H3

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 VFUDFLXHEMZKAR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.51
Topological Polar Surface Area 42.09
Polarizability 19.75
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Struchem co.,ltd
Supplier Profile
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C10H15NO2 $1,600.00-$3,190.00$1,600.00$1,760.00$3,190.00
Request Quote