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74531-15-0 | 4,5-Dimethylthiazole-2-carbaldehyde
CAS No: 74531-15-0 Catalog No: AG008PSH MDL No:MFCD11044203
Product Description
Catalog Number:
AG008PSH
Chemical Name:
4,5-Dimethylthiazole-2-carbaldehyde
CAS Number:
74531-15-0
Molecular Formula:
C6H7NOS
Molecular Weight:
141.1909
MDL Number:
MFCD11044203
IUPAC Name:
4,5-dimethyl-1,3-thiazole-2-carbaldehyde
InChI:
InChI=1S/C6H7NOS/c1-4-5(2)9-6(3-8)7-4/h3H,1-2H3
InChI Key:
RRBIYJOEJILQJE-UHFFFAOYSA-N
SMILES:
O=Cc1sc(c(n1)C)C
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.188g/mol
Monoisotopic Mass:
141.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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