Home Other Building Blocks [1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methanol

[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methanol

CAS No.:
372190-27-7
Catalog Number:
AG019JMH
Molecular Formula:
C14H12N2OS
Molecular Weight:
256.3229
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Product Description
Catalog Number:
AG019JMH
Chemical Name:
[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methanol
CAS Number:
372190-27-7
Molecular Formula:
C14H12N2OS
Molecular Weight:
256.3229
MDL Number:
MFCD01909759
IUPAC Name:
(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methanol
InChI:
InChI=1S/C14H12N2OS/c17-10-11-9-16(12-5-2-1-3-6-12)15-14(11)13-7-4-8-18-13/h1-9,17H,10H2
InChI Key:
VXPKOZBAZPODMY-UHFFFAOYSA-N
SMILES:
OCc1cn(nc1c1cccs1)c1ccccc1
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.067g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.323g/mol
Monoisotopic Mass:
256.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties