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Home Carboxys Ethyl 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Ethyl 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS No.:
14559-12-7
Catalog Number:
AG001D7P
Molecular Formula:
C11H14O2S
Molecular Weight:
210.2927
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG001D7P
Chemical Name:
Ethyl 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS Number:
14559-12-7
Molecular Formula:
C11H14O2S
Molecular Weight:
210.2927
MDL Number:
MFCD01838496
IUPAC Name:
ethyl 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
InChI:
InChI=1S/C11H14O2S/c1-2-13-11(12)9-7-14-10-6-4-3-5-8(9)10/h7H,2-6H2,1H3
InChI Key:
PRLFFGNMYPVCOW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1csc2c1CCCC2
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.071g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.291g/mol
Monoisotopic Mass:
210.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties