Home Aldehydes 1-methyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde

1-methyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde

CAS No.:
689251-87-4
Catalog Number:
AG01A41X
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
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Product Description
Catalog Number:
AG01A41X
Chemical Name:
1-methyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde
CAS Number:
689251-87-4
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
MDL Number:
MFCD11103099
IUPAC Name:
1-methyl-3-thiophen-2-ylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C9H8N2OS/c1-11-5-7(6-12)9(10-11)8-3-2-4-13-8/h2-6H,1H3
InChI Key:
NHWUUEJJXONEMW-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1cccs1)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.036g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.236g/mol
Monoisotopic Mass:
192.036g/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