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1353986-43-2 | 2-(Isopropyl-thiazol-5-ylmethyl-amino)-ethanol
CAS No: 1353986-43-2 Catalog No: AG01FA2T MDL No:
Product Description
Catalog Number:
AG01FA2T
Chemical Name:
2-(Isopropyl-thiazol-5-ylmethyl-amino)-ethanol
CAS Number:
1353986-43-2
Molecular Formula:
C9H16N2OS
Molecular Weight:
200.3011
IUPAC Name:
2-[propan-2-yl(1,3-thiazol-5-ylmethyl)amino]ethanol
InChI:
InChI=1S/C9H16N2OS/c1-8(2)11(3-4-12)6-9-5-10-7-13-9/h5,7-8,12H,3-4,6H2,1-2H3
InChI Key:
KFJXDESDRPJRKZ-UHFFFAOYSA-N
SMILES:
OCCN(C(C)C)Cc1scnc1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.098g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.3g/mol
Monoisotopic Mass:
200.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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