200,000+ products from a single source!
sales@angenechem.com
146137-90-8 | Benzo[b]thiophene-2-carboxylic acid, 5-iodo-, methyl ester
CAS No: 146137-90-8 Catalog No: AG001DPU MDL No:
Product Description
Catalog Number:
AG001DPU
Chemical Name:
Benzo[b]thiophene-2-carboxylic acid, 5-iodo-, methyl ester
CAS Number:
146137-90-8
Molecular Formula:
C10H7IO2S
Molecular Weight:
318.1309
IUPAC Name:
methyl 5-iodo-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C10H7IO2S/c1-13-10(12)9-5-6-4-7(11)2-3-8(6)14-9/h2-5H,1H3
InChI Key:
HEGKKJCDOJECPN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c(s1)ccc(c2)I
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.921g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.128g/mol
Monoisotopic Mass:
317.921g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.