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14542-12-2 | 1,3-Thiazol-2-Ylmethanol
CAS No: 14542-12-2 Catalog No: AG001D12 MDL No:MFCD06200855
Product Description
Catalog Number:
AG001D12
Chemical Name:
1,3-Thiazol-2-Ylmethanol
CAS Number:
14542-12-2
Molecular Formula:
C4H5NOS
Molecular Weight:
115.1536
MDL Number:
MFCD06200855
IUPAC Name:
1,3-thiazol-2-ylmethanol
InChI:
InChI=1S/C4H5NOS/c6-3-4-5-1-2-7-4/h1-2,6H,3H2
InChI Key:
JNHDLNXNYPLBMJ-UHFFFAOYSA-N
SMILES:
OCc1nccs1
Properties
Complexity:
59.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.009g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
115.15g/mol
Monoisotopic Mass:
115.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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