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1353962-44-3 | 2-(Methyl-thiazol-5-ylmethyl-amino)-ethanol
CAS No: 1353962-44-3 Catalog No: AG01FAXO MDL No:
Product Description
Catalog Number:
AG01FAXO
Chemical Name:
2-(Methyl-thiazol-5-ylmethyl-amino)-ethanol
CAS Number:
1353962-44-3
Molecular Formula:
C7H12N2OS
Molecular Weight:
172.2480
IUPAC Name:
2-[methyl(1,3-thiazol-5-ylmethyl)amino]ethanol
InChI:
InChI=1S/C7H12N2OS/c1-9(2-3-10)5-7-4-8-6-11-7/h4,6,10H,2-3,5H2,1H3
InChI Key:
UDFXSPVDWHWVGL-UHFFFAOYSA-N
SMILES:
CN(CCO)Cc1cncs1
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.067g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.246g/mol
Monoisotopic Mass:
172.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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