Name: Name:Benzoic acid, 4-(5-chloro-2-thienyl)-, sodium salt (1:1)
Brand: Angene
SKU: AG002V9X
Rating: 90 (10 reviews)

Benzoic acid, 4-(5-chloro-2-thienyl)-, sodium salt (1:1)

CAS No.:

290326-23-7

Catalog Number:

AG002V9X

Molecular Formula:

C11H6ClNaO2S

Molecular Weight:

260.6719

Catalog Number:

AG002V9X

Chemical Name:

Benzoic acid, 4-(5-chloro-2-thienyl)-, sodium salt (1:1)

CAS Number:

290326-23-7

Molecular Formula:

C11H6ClNaO2S

Molecular Weight:

260.6719

MDL Number:

MFCD11977459

IUPAC Name:

4-(5-chlorothiophen-2-yl)benzoic acid

InChI:

InChI=1S/C11H7ClO2S/c12-10-6-5-9(15-10)7-1-3-8(4-2-7)11(13)14/h1-6H,(H,13,14)

InChI Key:

HHYWNBOMTAPIOO-UHFFFAOYSA-N

SMILES:

[O-]C(=O)c1ccc(cc1)c1ccc(s1)Cl.[Na+]

Complexity:

239

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.986g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.685g/mol

Monoisotopic Mass:

237.986g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8