Name: Name:1-benzyl 2-methyl 4,5-dihydro-1H-pyrrole-1,2-dicarboxylate
Brand: Angene
SKU: AG01AFQA
Rating: 90 (10 reviews)

1-benzyl 2-methyl 4,5-dihydro-1H-pyrrole-1,2-dicarboxylate

CAS No.:

72978-22-4

Catalog Number:

AG01AFQA

Molecular Formula:

C14H15NO4

Molecular Weight:

261.2732

Catalog Number:

AG01AFQA

Chemical Name:

1-benzyl 2-methyl 4,5-dihydro-1H-pyrrole-1,2-dicarboxylate

CAS Number:

72978-22-4

Molecular Formula:

C14H15NO4

Molecular Weight:

261.2732

MDL Number:

MFCD23378655

IUPAC Name:

1-O-benzyl 5-O-methyl 2,3-dihydropyrrole-1,5-dicarboxylate

InChI:

InChI=1S/C14H15NO4/c1-18-13(16)12-8-5-9-15(12)14(17)19-10-11-6-3-2-4-7-11/h2-4,6-8H,5,9-10H2,1H3

InChI Key:

ANIXOIHULJVBGF-UHFFFAOYSA-N

SMILES:

COC(=O)C1=CCCN1C(=O)OCc1ccccc1

Complexity:

372

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.277g/mol

Monoisotopic Mass:

261.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1