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7565-40-4

7565-40-4 | 2-(propan-2-ylsulfanyl)-1H-imidazole

CAS No: 7565-40-4 Catalog No: AG01BCPW MDL No:MFCD19219017

Product Description

Catalog Number:
AG01BCPW
Chemical Name:
2-(propan-2-ylsulfanyl)-1H-imidazole
CAS Number:
7565-40-4
Molecular Formula:
C6H10N2S
Molecular Weight:
142.2220
MDL Number:
MFCD19219017
IUPAC Name:
2-propan-2-ylsulfanyl-1H-imidazole
InChI:
InChI=1S/C6H10N2S/c1-5(2)9-6-7-3-4-8-6/h3-5H,1-2H3,(H,7,8)
InChI Key:
HSQPCUWZLDLVHC-UHFFFAOYSA-N
SMILES:
CC(Sc1ncc[nH]1)C

Properties

Complexity:
85.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.056g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.22g/mol
Monoisotopic Mass:
142.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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