Name: Name:3-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]benzoic acid
Brand: Angene
SKU: AG01A4Q2
Rating: 90 (10 reviews)

3-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]benzoic acid

CAS No.:

1432678-74-4

Catalog Number:

AG01A4Q2

Molecular Formula:

C11H10N2O4

Molecular Weight:

234.2081

Catalog Number:

AG01A4Q2

Chemical Name:

3-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]benzoic acid

CAS Number:

1432678-74-4

Molecular Formula:

C11H10N2O4

Molecular Weight:

234.2081

MDL Number:

MFCD19023647

IUPAC Name:

3-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]benzoic acid

InChI:

InChI=1S/C11H10N2O4/c1-16-6-9-12-13-10(17-9)7-3-2-4-8(5-7)11(14)15/h2-5H,6H2,1H3,(H,14,15)

InChI Key:

DAGKJRITTPHHRD-UHFFFAOYSA-N

SMILES:

COCc1nnc(o1)c1cccc(c1)C(=O)O

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.211g/mol

Monoisotopic Mass:

234.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

85.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6