Name: Name:3-(2-chlorophenoxymethyl)-1-benzofuran-2-carboxylic acid
Brand: Angene
SKU: AG01A9HX
Rating: 90 (10 reviews)

3-(2-chlorophenoxymethyl)-1-benzofuran-2-carboxylic acid

CAS No.:

1039891-11-6

Catalog Number:

AG01A9HX

Molecular Formula:

C16H11ClO4

Molecular Weight:

302.7091

Catalog Number:

AG01A9HX

Chemical Name:

3-(2-chlorophenoxymethyl)-1-benzofuran-2-carboxylic acid

CAS Number:

1039891-11-6

Molecular Formula:

C16H11ClO4

Molecular Weight:

302.7091

MDL Number:

MFCD13381158

IUPAC Name:

3-[(2-chlorophenoxy)methyl]-1-benzofuran-2-carboxylic acid

InChI:

InChI=1S/C16H11ClO4/c17-12-6-2-4-8-14(12)20-9-11-10-5-1-3-7-13(10)21-15(11)16(18)19/h1-8H,9H2,(H,18,19)

InChI Key:

ZNXLPPWUYISSRD-UHFFFAOYSA-N

SMILES:

OC(=O)c1oc2c(c1COc1ccccc1Cl)cccc2

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

302.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

302.71g/mol

Monoisotopic Mass:

302.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3