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Home > Aldehydes > 142230-96-4
142230-96-4 | 2,5-DIMETHYL-1-(1,3-THIAZOL-2-YL)-1H-PYRROLE-3-CARBALDEHYDE
CAS No: 142230-96-4 Catalog No: AG009B4M MDL No:MFCD06655933
Product Description
Catalog Number:
AG009B4M
Chemical Name:
2,5-DIMETHYL-1-(1,3-THIAZOL-2-YL)-1H-PYRROLE-3-CARBALDEHYDE
CAS Number:
142230-96-4
Molecular Formula:
C10H10N2OS
Molecular Weight:
206.2642
MDL Number:
MFCD06655933
IUPAC Name:
2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carbaldehyde
InChI:
InChI=1S/C10H10N2OS/c1-7-5-9(6-13)8(2)12(7)10-11-3-4-14-10/h3-6H,1-2H3
InChI Key:
POOXCXKWGLDXNJ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(n(c1C)c1nccs1)C
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.263g/mol
Monoisotopic Mass:
206.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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