Home Halogens Methyl 4-bromobenzo[b]thiophene-2-carboxylate

Methyl 4-bromobenzo[b]thiophene-2-carboxylate

CAS No.:
360575-29-7
Catalog Number:
AG00C8B2
Molecular Formula:
C10H7BrO2S
Molecular Weight:
271.1304
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$275
- +
25g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00C8B2
Chemical Name:
Methyl 4-bromobenzo[b]thiophene-2-carboxylate
CAS Number:
360575-29-7
Molecular Formula:
C10H7BrO2S
Molecular Weight:
271.1304
MDL Number:
MFCD07371547
IUPAC Name:
methyl 4-bromo-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C10H7BrO2S/c1-13-10(12)9-5-6-7(11)3-2-4-8(6)14-9/h2-5H,1H3
InChI Key:
AOQIBJZMRMVKSH-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc2c(c1)c(Br)ccc2
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.935g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.128g/mol
Monoisotopic Mass:
269.935g/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  
Properties