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199991-61-2 | 5-thiazoleacetic acid, 2-amino-4-hydroxy-
CAS No: 199991-61-2 Catalog No: AG002CHO MDL No:
Product Description
Catalog Number:
AG002CHO
Chemical Name:
5-thiazoleacetic acid, 2-amino-4-hydroxy-
CAS Number:
199991-61-2
Molecular Formula:
C5H6N2O3S
Molecular Weight:
174.1777
IUPAC Name:
2-(2-amino-4-hydroxy-1,3-thiazol-5-yl)acetic acid
InChI:
InChI=1S/C5H6N2O3S/c6-5-7-4(10)2(11-5)1-3(8)9/h10H,1H2,(H2,6,7)(H,8,9)
InChI Key:
YMUQFCODCOKKEL-UHFFFAOYSA-N
SMILES:
Nc1nc(c(s1)CC(=O)O)O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.01g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
174.174g/mol
Monoisotopic Mass:
174.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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