Name: Name:8-ethoxy-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid
Brand: Angene
SKU: AG01ABD7
Rating: 90 (10 reviews)

8-ethoxy-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

CAS No.:

923243-36-1

Catalog Number:

AG01ABD7

Molecular Formula:

C12H14O4

Molecular Weight:

222.2372

Catalog Number:

AG01ABD7

Chemical Name:

8-ethoxy-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

CAS Number:

923243-36-1

Molecular Formula:

C12H14O4

Molecular Weight:

222.2372

MDL Number:

MFCD08444804

IUPAC Name:

8-ethoxy-3,4-dihydro-2H-chromene-3-carboxylic acid

InChI:

InChI=1S/C12H14O4/c1-2-15-10-5-3-4-8-6-9(12(13)14)7-16-11(8)10/h3-5,9H,2,6-7H2,1H3,(H,13,14)

InChI Key:

HXLKJFYRNADSBA-UHFFFAOYSA-N

SMILES:

CCOc1cccc2c1OCC(C2)C(=O)O

Complexity:

253

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.24g/mol

Monoisotopic Mass:

222.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8