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Home > Aldehydes > 1566920-41-9
1566920-41-9 | 4-(PIPERAZIN-1-YL)THIOPHENE-2-CARBALDEHYDE
CAS No: 1566920-41-9 Catalog No: AG01C8OD MDL No:MFCD26866508
Product Description
Catalog Number:
AG01C8OD
Chemical Name:
4-(PIPERAZIN-1-YL)THIOPHENE-2-CARBALDEHYDE
CAS Number:
1566920-41-9
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD26866508
IUPAC Name:
4-piperazin-1-ylthiophene-2-carbaldehyde
InChI:
InChI=1S/C9H12N2OS/c12-6-9-5-8(7-13-9)11-3-1-10-2-4-11/h5-7,10H,1-4H2
InChI Key:
QAVJQBCMHZTGIW-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1)N1CCNCC1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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