Home Aldehydes 4-(1H-imidazol-1-yl)thiophene-2-carbaldehyde

4-(1H-imidazol-1-yl)thiophene-2-carbaldehyde

CAS No.:
91163-89-2
Catalog Number:
AG01A5W0
Molecular Formula:
C8H6N2OS
Molecular Weight:
178.2110
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Product Description
Catalog Number:
AG01A5W0
Chemical Name:
4-(1H-imidazol-1-yl)thiophene-2-carbaldehyde
CAS Number:
91163-89-2
Molecular Formula:
C8H6N2OS
Molecular Weight:
178.2110
MDL Number:
MFCD08668346
IUPAC Name:
4-imidazol-1-ylthiophene-2-carbaldehyde
InChI:
InChI=1S/C8H6N2OS/c11-4-8-3-7(5-12-8)10-2-1-9-6-10/h1-6H
InChI Key:
NETHONVYJZOPMN-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1)n1cncc1
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.209g/mol
Monoisotopic Mass:
178.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties