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2091252-71-8 | 4-(3-methoxy-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
CAS No: 2091252-71-8 Catalog No: AG01BSQV MDL No:MFCD30538900
Product Description
Catalog Number:
AG01BSQV
Chemical Name:
4-(3-methoxy-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
CAS Number:
2091252-71-8
Molecular Formula:
C9H7NO2S2
Molecular Weight:
225.2874
MDL Number:
MFCD30538900
IUPAC Name:
4-(3-methoxy-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H7NO2S2/c1-12-9-3-8(14-10-9)6-2-7(4-11)13-5-6/h2-5H,1H3
InChI Key:
SONWJDGWODAMDM-UHFFFAOYSA-N
SMILES:
COc1nsc(c1)c1csc(c1)C=O
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.992g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.28g/mol
Monoisotopic Mass:
224.992g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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