Name: Name:2-chloro-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one
Brand: Angene
SKU: AG00ICCZ
Rating: 90 (10 reviews)

2-chloro-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one

CAS No.:

731003-81-9

Catalog Number:

AG00ICCZ

Molecular Formula:

C16H16ClNO3

Molecular Weight:

305.7561

Catalog Number:

AG00ICCZ

Chemical Name:

2-chloro-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one

CAS Number:

731003-81-9

Molecular Formula:

C16H16ClNO3

Molecular Weight:

305.7561

MDL Number:

MFCD26959481

IUPAC Name:

2-chloro-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone

InChI:

InChI=1S/C16H16ClNO3/c1-10-7-13(14(19)9-17)11(2)18(10)12-3-4-15-16(8-12)21-6-5-20-15/h3-4,7-8H,5-6,9H2,1-2H3

InChI Key:

MEJKHNWAWMQUFC-UHFFFAOYSA-N

SMILES:

ClCC(=O)c1cc(n(c1C)c1ccc2c(c1)OCCO2)C

Complexity:

392

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

305.082g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

305.758g/mol

Monoisotopic Mass:

305.082g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1