Home Other Building Blocks D-3-Benzothienylalanine

D-3-Benzothienylalanine

CAS No.:
111139-55-0
Catalog Number:
AG0037Z1
Molecular Formula:
C11H11NO2S
Molecular Weight:
221.2755
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (Assay on anhydrous basis)
1 week
United States
$111
- +
1g
≥ 99% (Assay on anhydrous basis)
1 week
United States
$170
- +
5g
≥ 99% (Assay on anhydrous basis)
1 week
United States
$637
- +
Product Description
Catalog Number:
AG0037Z1
Chemical Name:
D-3-Benzothienylalanine
CAS Number:
111139-55-0
Molecular Formula:
C11H11NO2S
Molecular Weight:
221.2755
MDL Number:
MFCD00079683
IUPAC Name:
(2R)-2-amino-3-(1-benzothiophen-3-yl)propanoic acid
InChI:
InChI=1S/C11H11NO2S/c12-9(11(13)14)5-7-6-15-10-4-2-1-3-8(7)10/h1-4,6,9H,5,12H2,(H,13,14)/t9-/m1/s1
InChI Key:
GAUUPDQWKHTCAX-SECBINFHSA-N
SMILES:
OC(=O)[C@H](Cc1csc2c1cccc2)N
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
221.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.274g/mol
Monoisotopic Mass:
221.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties