Name: Name:3-[(5-bromothiophen-3-yl)methoxy]-4-methylbenzoic acid
Brand: Angene
SKU: AG019QLN
Rating: 90 (10 reviews)

3-[(5-bromothiophen-3-yl)methoxy]-4-methylbenzoic acid

CAS No.:

1293039-30-1

Catalog Number:

AG019QLN

Molecular Formula:

C13H11BrO3S

Molecular Weight:

327.1936

Catalog Number:

AG019QLN

Chemical Name:

3-[(5-bromothiophen-3-yl)methoxy]-4-methylbenzoic acid

CAS Number:

1293039-30-1

Molecular Formula:

C13H11BrO3S

Molecular Weight:

327.1936

MDL Number:

MFCD13473854

IUPAC Name:

3-[(5-bromothiophen-3-yl)methoxy]-4-methylbenzoic acid

InChI:

InChI=1S/C13H11BrO3S/c1-8-2-3-10(13(15)16)5-11(8)17-6-9-4-12(14)18-7-9/h2-5,7H,6H2,1H3,(H,15,16)

InChI Key:

QJFLFJMXQSAROL-UHFFFAOYSA-N

SMILES:

Brc1scc(c1)COc1cc(ccc1C)C(=O)O

Complexity:

300

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

325.961g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.192g/mol

Monoisotopic Mass:

325.961g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: