Name: Name:1-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
Brand: Angene
SKU: AG00GSTL
Rating: 90 (10 reviews)

1-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE

CAS No.:

878427-40-8

Catalog Number:

AG00GSTL

Molecular Formula:

C15H15NO3

Molecular Weight:

257.2845

Catalog Number:

AG00GSTL

Chemical Name:

1-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE

CAS Number:

878427-40-8

Molecular Formula:

C15H15NO3

Molecular Weight:

257.2845

MDL Number:

MFCD07186522

IUPAC Name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrole-3-carbaldehyde

InChI:

InChI=1S/C15H15NO3/c1-10-7-12(9-17)11(2)16(10)13-3-4-14-15(8-13)19-6-5-18-14/h3-4,7-9H,5-6H2,1-2H3

InChI Key:

MGVJGSGMITZAIX-UHFFFAOYSA-N

SMILES:

O=Cc1cc(n(c1C)c1ccc2c(c1)OCCO2)C

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.289g/mol

Monoisotopic Mass:

257.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3