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923862-35-5

923862-35-5 | 1-(2-FURYLMETHYL)-5-PHENYL-1H-IMIDAZOLE-2-THIOL

CAS No: 923862-35-5 Catalog No: AG00GUE2 MDL No:MFCD08691252

Product Description

Catalog Number:
AG00GUE2
Chemical Name:
1-(2-FURYLMETHYL)-5-PHENYL-1H-IMIDAZOLE-2-THIOL
CAS Number:
923862-35-5
Molecular Formula:
C14H12N2OS
Molecular Weight:
256.3229
MDL Number:
MFCD08691252
IUPAC Name:
3-(furan-2-ylmethyl)-4-phenyl-1H-imidazole-2-thione
InChI:
InChI=1S/C14H12N2OS/c18-14-15-9-13(11-5-2-1-3-6-11)16(14)10-12-7-4-8-17-12/h1-9H,10H2,(H,15,18)
InChI Key:
UDOSIFRCNNSQCV-UHFFFAOYSA-N
SMILES:
S=c1[nH]cc(n1Cc1ccco1)c1ccccc1

Properties

Complexity:
350  
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:
2  
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:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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