Home Halogens tert-Butyl 2-bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4h)-carboxylate

tert-Butyl 2-bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4h)-carboxylate

CAS No.:
949922-62-7
Catalog Number:
AG006QF7
Molecular Formula:
C12H16BrNO2S
Molecular Weight:
318.2299
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$63
- +
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG006QF7
Chemical Name:
tert-Butyl 2-bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4h)-carboxylate
CAS Number:
949922-62-7
Molecular Formula:
C12H16BrNO2S
Molecular Weight:
318.2299
MDL Number:
MFCD09878703
IUPAC Name:
tert-butyl 2-bromo-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate
InChI:
InChI=1S/C12H16BrNO2S/c1-12(2,3)16-11(15)14-5-4-9-8(7-14)6-10(13)17-9/h6H,4-5,7H2,1-3H3
InChI Key:
ALVKHVFHUNINLV-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c(C1)cc(s2)Br)OC(C)(C)C
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.009g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.229g/mol
Monoisotopic Mass:
317.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties