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1566311-24-7

1566311-24-7 | 4-(3-OXOPIPERAZIN-1-YL)THIOPHENE-2-CARBALDEHYDE

CAS No: 1566311-24-7 Catalog No: AG01C8OH MDL No:MFCD26866301

Product Description

Catalog Number:
AG01C8OH
Chemical Name:
4-(3-OXOPIPERAZIN-1-YL)THIOPHENE-2-CARBALDEHYDE
CAS Number:
1566311-24-7
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
MDL Number:
MFCD26866301
IUPAC Name:
4-(3-oxopiperazin-1-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H10N2O2S/c12-5-8-3-7(6-14-8)11-2-1-10-9(13)4-11/h3,5-6H,1-2,4H2,(H,10,13)
InChI Key:
LUDOIYVESOSNES-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1)N1CCNC(=O)C1

Properties

Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.251g/mol
Monoisotopic Mass:
210.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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