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72816-74-1

72816-74-1 | 2H-Imidazole-2-thione,1-decyl-1,3-dihydro-

CAS No: 72816-74-1 Catalog No: AG005OP6 MDL No:

Product Description

Catalog Number:
AG005OP6
Chemical Name:
2H-Imidazole-2-thione,1-decyl-1,3-dihydro-
CAS Number:
72816-74-1
Molecular Formula:
C13H24N2S
Molecular Weight:
240.4081
IUPAC Name:
3-decyl-1H-imidazole-2-thione
InChI:
InChI=1S/C13H24N2S/c1-2-3-4-5-6-7-8-9-11-15-12-10-14-13(15)16/h10,12H,2-9,11H2,1H3,(H,14,16)
InChI Key:
JDIVIRKXRABDRT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCn1cc[nH]c1=S
NSC Number:
360510

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.166g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.409g/mol
Monoisotopic Mass:
240.166g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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