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1934828-10-0 | 3-(3-methoxy-1,2-thiazol-5-yl)benzaldehyde
CAS No: 1934828-10-0 Catalog No: AG01BSQT MDL No:MFCD30538894
Product Description
Catalog Number:
AG01BSQT
Chemical Name:
3-(3-methoxy-1,2-thiazol-5-yl)benzaldehyde
CAS Number:
1934828-10-0
Molecular Formula:
C11H9NO2S
Molecular Weight:
219.2597
MDL Number:
MFCD30538894
IUPAC Name:
3-(3-methoxy-1,2-thiazol-5-yl)benzaldehyde
InChI:
InChI=1S/C11H9NO2S/c1-14-11-6-10(15-12-11)9-4-2-3-8(5-9)7-13/h2-7H,1H3
InChI Key:
XFCBEBPFTFGFEO-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1snc(c1)OC
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.035g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.258g/mol
Monoisotopic Mass:
219.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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