Home Carboxys Methyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Methyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS No.:
308292-45-7
Catalog Number:
AG00BEGW
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$99
- +
1g
1 week
United States
$212
- +
Product Description
Catalog Number:
AG00BEGW
Chemical Name:
Methyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS Number:
308292-45-7
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD01114962
IUPAC Name:
methyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
InChI:
InChI=1S/C11H15NO2S/c1-6-3-4-7-8(5-6)15-10(12)9(7)11(13)14-2/h6H,3-5,12H2,1-2H3
InChI Key:
YHYBWJHQHFHSSW-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(N)sc2c1CCC(C2)C
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties