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95453-59-1 | 2-Methoxythiazole-5-carbaldehyde
CAS No: 95453-59-1 Catalog No: AG0036WF MDL No:MFCD09693732
Product Description
Catalog Number:
AG0036WF
Chemical Name:
2-Methoxythiazole-5-carbaldehyde
CAS Number:
95453-59-1
Molecular Formula:
C5H5NO2S
Molecular Weight:
143.1637
MDL Number:
MFCD09693732
IUPAC Name:
2-methoxy-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C5H5NO2S/c1-8-5-6-2-4(3-7)9-5/h2-3H,1H3
InChI Key:
XTXZVLUCJBYWFC-UHFFFAOYSA-N
SMILES:
COc1ncc(s1)C=O
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.004g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.16g/mol
Monoisotopic Mass:
143.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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