Home Other Building Blocks (S)-3-Thienylglycine

(S)-3-Thienylglycine

CAS No.:
1194-87-2
Catalog Number:
AG000IPE
Molecular Formula:
C6H7NO2S
Molecular Weight:
157.1903
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98%
1 week
United States
$133
- +
250mg
≥ 98%
1 week
United States
$228
- +
1g
≥ 98%
1 week
United States
$418
- +
5g
≥ 98%
1 week
United States
$1595
- +
Product Description
Catalog Number:
AG000IPE
Chemical Name:
(S)-3-Thienylglycine
CAS Number:
1194-87-2
Molecular Formula:
C6H7NO2S
Molecular Weight:
157.1903
MDL Number:
MFCD00079617
IUPAC Name:
(2S)-2-amino-2-thiophen-3-ylacetic acid
InChI:
InChI=1S/C6H7NO2S/c7-5(6(8)9)4-1-2-10-3-4/h1-3,5H,7H2,(H,8,9)/t5-/m0/s1
InChI Key:
BVGBBSAQOQTNGF-YFKPBYRVSA-N
SMILES:
OC(=O)[C@H](c1cscc1)N
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
157.02g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
157.187g/mol
Monoisotopic Mass:
157.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2  
Literature
Title Journal
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties