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Home > Imidazoles > 100528-36-7
100528-36-7 | 2-(decylsulfanyl)-4,5-dihydro-1H-imidazole
CAS No: 100528-36-7 Catalog No: AG01BGQ0 MDL No:MFCD28125214
Product Description
Catalog Number:
AG01BGQ0
Chemical Name:
2-(decylsulfanyl)-4,5-dihydro-1H-imidazole
CAS Number:
100528-36-7
Molecular Formula:
C13H26N2S
Molecular Weight:
242.4239
MDL Number:
MFCD28125214
IUPAC Name:
2-decylsulfanyl-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C13H26N2S/c1-2-3-4-5-6-7-8-9-12-16-13-14-10-11-15-13/h2-12H2,1H3,(H,14,15)
InChI Key:
CHSDMTMIOQSVJL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCSC1=NCCN1
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.182g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.425g/mol
Monoisotopic Mass:
242.182g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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