Name: Name:Benzoic acid,3-(1,3-dioxolan-2-ylmethoxy)-, ethyl ester
Brand: Angene
SKU: AG0038EF
Rating: 90 (10 reviews)

Benzoic acid,3-(1,3-dioxolan-2-ylmethoxy)-, ethyl ester

CAS No.:

850348-88-8

Catalog Number:

AG0038EF

Molecular Formula:

C13H16O5

Molecular Weight:

252.2631

Catalog Number:

AG0038EF

Chemical Name:

Benzoic acid,3-(1,3-dioxolan-2-ylmethoxy)-, ethyl ester

CAS Number:

850348-88-8

Molecular Formula:

C13H16O5

Molecular Weight:

252.2631

MDL Number:

MFCD06657701

IUPAC Name:

ethyl 3-(1,3-dioxolan-2-ylmethoxy)benzoate

InChI:

InChI=1S/C13H16O5/c1-2-15-13(14)10-4-3-5-11(8-10)18-9-12-16-6-7-17-12/h3-5,8,12H,2,6-7,9H2,1H3

InChI Key:

WHUHWYZQAUTDRM-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cccc(c1)OCC1OCCO1

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.266g/mol

Monoisotopic Mass:

252.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8