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1353952-01-8 | 2-[Isopropyl-(1-thiazol-2-yl-ethyl)-amino]-ethanol
CAS No: 1353952-01-8 Catalog No: AG01F900 MDL No:
Product Description
Catalog Number:
AG01F900
Chemical Name:
2-[Isopropyl-(1-thiazol-2-yl-ethyl)-amino]-ethanol
CAS Number:
1353952-01-8
Molecular Formula:
C10H18N2OS
Molecular Weight:
214.3277
IUPAC Name:
2-[propan-2-yl-[1-(1,3-thiazol-2-yl)ethyl]amino]ethanol
InChI:
InChI=1S/C10H18N2OS/c1-8(2)12(5-6-13)9(3)10-11-4-7-14-10/h4,7-9,13H,5-6H2,1-3H3
InChI Key:
ZOVCTIRFHIFLAW-UHFFFAOYSA-N
SMILES:
OCCN(C(c1nccs1)C)C(C)C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.114g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.327g/mol
Monoisotopic Mass:
214.114g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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