Name: Name:Benzo[b]thiophene-2-carboxylic acid, 5-nitro-, methyl ester
Brand: Angene
SKU: AG002ISM
Rating: 90 (10 reviews)

Benzo[b]thiophene-2-carboxylic acid, 5-nitro-, methyl ester

CAS No.:

20699-86-9

Catalog Number:

AG002ISM

Molecular Formula:

C10H7NO4S

Molecular Weight:

237.2319

Catalog Number:

AG002ISM

Chemical Name:

Benzo[b]thiophene-2-carboxylic acid, 5-nitro-, methyl ester

CAS Number:

20699-86-9

Molecular Formula:

C10H7NO4S

Molecular Weight:

237.2319

MDL Number:

MFCD03618409

IUPAC Name:

methyl 5-nitro-1-benzothiophene-2-carboxylate

InChI:

InChI=1S/C10H7NO4S/c1-15-10(12)9-5-6-4-7(11(13)14)2-3-8(6)16-9/h2-5H,1H3

InChI Key:

OSVZEJHBIFIMJF-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-]

Complexity:

304

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

237.229g/mol

Monoisotopic Mass:

237.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: