| CAS Number | 6332-87-2 |
| Catalog Number | AG00J255(AGN-PC-0WB5FP) |
| Chemical Name | 2-(2-Thienyl)alanine |
| IUPAC Name | 2-amino-2-thiophen-2-ylpropanoic acid |
| InChI | InChI=1S/C7H9NO2S/c1-7(8,6(9)10)5-3-2-4-11-5/h2-4H,8H2,1H3,(H,9,10) |
| InChI Key | DJXMNZLSBCANRG-UHFFFAOYSA-N |
| MDL Number | MFCD12402128 |
| Molecular Formula | C7H9NO2S |
| Molecular Weight | 171.2169 |
| NSC Number | 38745 |
| SMILES | C(C)(N)(C(O)=O)C1=CC=CS1 |
| Synonyms | 2-(2-thienyl)alanine,
2-amino-2-(thiophen-2-yl)propanoic acid,
6332-87-2,
NSC38745,
AC1L5WDF,
SCHEMBL599752,
CTK7I4310,
DJXMNZLSBCANRG-UHFFFAOYSA-N,
ZX-CM008039,
MFCD12402128,
NSC-38745,
2-amino-2-(2-thienyl)propanoic acid,
AKOS002683179,
AKOS016050029,
2-amino-2-thiophen-2-ylpropanoic acid,
FCH1012609,
Y-7191,
I04-0122,
CID236333,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.214g/mol |
| Monoisotopic Mass | 171.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 91.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number