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Home > Thiazole > 1247198-05-5
1247198-05-5 | 1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethan-1-ol
CAS No: 1247198-05-5 Catalog No: AG01AKGI MDL No:MFCD16112723
Product Description
Catalog Number:
AG01AKGI
Chemical Name:
1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethan-1-ol
CAS Number:
1247198-05-5
Molecular Formula:
C8H13NOS
Molecular Weight:
171.2599
MDL Number:
MFCD16112723
IUPAC Name:
1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethanol
InChI:
InChI=1S/C8H13NOS/c1-4-7-9-5(2)8(11-7)6(3)10/h6,10H,4H2,1-3H3
InChI Key:
WCQXPDSIATYONZ-UHFFFAOYSA-N
SMILES:
CCc1nc(c(s1)C(O)C)C
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.072g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.258g/mol
Monoisotopic Mass:
171.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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