3-(2-amino-1,3-thiazol-4-yl)phenol;hydrochloride


Chemical Name: 3-(2-amino-1,3-thiazol-4-yl)phenol;hydrochloride
CAS Number: 1050556-38-1
Product Number: AG003I01(AGN-PC-01C0PF)
Synonyms:
MDL No: MFCD08582775
Molecular Formula: C9H9ClN2OS
Molecular Weight: 228.6986

Identification/Properties


Computed Properties
Molecular Weight:
228.694g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
228.012g/mol
Monoisotopic Mass:
228.012g/mol
Topological Polar Surface Area:
87.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
179
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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