Name: Name:ethyl 3-(3,4-dihydro-1H-2-benzopyran-1-yl)-2-oxopropanoate
Brand: Angene
SKU: AG01A9FV
Rating: 90 (10 reviews)

ethyl 3-(3,4-dihydro-1H-2-benzopyran-1-yl)-2-oxopropanoate

CAS No.:

886986-87-4

Catalog Number:

AG01A9FV

Molecular Formula:

C14H16O4

Molecular Weight:

248.2744

Catalog Number:

AG01A9FV

Chemical Name:

ethyl 3-(3,4-dihydro-1H-2-benzopyran-1-yl)-2-oxopropanoate

CAS Number:

886986-87-4

Molecular Formula:

C14H16O4

Molecular Weight:

248.2744

MDL Number:

MFCD16817407

IUPAC Name:

ethyl 3-(3,4-dihydro-1H-isochromen-1-yl)-2-oxopropanoate

InChI:

InChI=1S/C14H16O4/c1-2-17-14(16)12(15)9-13-11-6-4-3-5-10(11)7-8-18-13/h3-6,13H,2,7-9H2,1H3

InChI Key:

STIICXZMUZFNQB-UHFFFAOYSA-N

SMILES:

CCOC(=O)C(=O)CC1OCCc2c1cccc2

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.278g/mol

Monoisotopic Mass:

248.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7