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Home > Aldehydes > 129880-84-8
129880-84-8 | 5-Thiazolecarboxaldehyde, 4-chloro-2-(4-morpholinyl)-
CAS No: 129880-84-8 Catalog No: AG000TS2 MDL No:MFCD03453087
Product Description
Catalog Number:
AG000TS2
Chemical Name:
5-Thiazolecarboxaldehyde, 4-chloro-2-(4-morpholinyl)-
CAS Number:
129880-84-8
Molecular Formula:
C8H9ClN2O2S
Molecular Weight:
232.6873
MDL Number:
MFCD03453087
IUPAC Name:
4-chloro-2-morpholin-4-yl-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C8H9ClN2O2S/c9-7-6(5-12)14-8(10-7)11-1-3-13-4-2-11/h5H,1-4H2
InChI Key:
PXXGEJVHSHQARO-UHFFFAOYSA-N
SMILES:
O=Cc1sc(nc1Cl)N1CCOCC1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.007g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.682g/mol
Monoisotopic Mass:
232.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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