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1080060-62-3 | 5-(1-hydroxyethyl)-1,3-thiazole-2-carbaldehyde
CAS No: 1080060-62-3 Catalog No: AG01BF5R MDL No:MFCD24686875
Product Description
Catalog Number:
AG01BF5R
Chemical Name:
5-(1-hydroxyethyl)-1,3-thiazole-2-carbaldehyde
CAS Number:
1080060-62-3
Molecular Formula:
C6H7NO2S
Molecular Weight:
157.1903
MDL Number:
MFCD24686875
IUPAC Name:
5-(1-hydroxyethyl)-1,3-thiazole-2-carbaldehyde
InChI:
InChI=1S/C6H7NO2S/c1-4(9)5-2-7-6(3-8)10-5/h2-4,9H,1H3
InChI Key:
JSYDCUWOVYIYKJ-UHFFFAOYSA-N
SMILES:
O=Cc1ncc(s1)C(O)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:
157.02g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.187g/mol
Monoisotopic Mass:
157.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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