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99839-16-4 | (4,5-Dimethylthiazol-2-yl)methanol
CAS No: 99839-16-4 Catalog No: AG003W1E MDL No:MFCD12198452
Product Description
Catalog Number:
AG003W1E
Chemical Name:
(4,5-Dimethylthiazol-2-yl)methanol
CAS Number:
99839-16-4
Molecular Formula:
C6H9NOS
Molecular Weight:
143.2068
MDL Number:
MFCD12198452
IUPAC Name:
(4,5-dimethyl-1,3-thiazol-2-yl)methanol
InChI:
InChI=1S/C6H9NOS/c1-4-5(2)9-6(3-8)7-4/h8H,3H2,1-2H3
InChI Key:
NNZZUYMCPDVPQA-UHFFFAOYSA-N
SMILES:
OCc1sc(c(n1)C)C
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.04g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.204g/mol
Monoisotopic Mass:
143.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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