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125883-73-0 | 4-(thiophen-3-ylmethyl)-1H-imidazole
CAS No: 125883-73-0 Catalog No: AG01BCFJ MDL No:MFCD20662127
Product Description
Catalog Number:
AG01BCFJ
Chemical Name:
4-(thiophen-3-ylmethyl)-1H-imidazole
CAS Number:
125883-73-0
Molecular Formula:
C8H8N2S
Molecular Weight:
164.2275
MDL Number:
MFCD20662127
IUPAC Name:
5-(thiophen-3-ylmethyl)-1H-imidazole
InChI:
InChI=1S/C8H8N2S/c1-2-11-5-7(1)3-8-4-9-6-10-8/h1-2,4-6H,3H2,(H,9,10)
InChI Key:
MPRYSKNMRJZZIQ-UHFFFAOYSA-N
SMILES:
c1scc(c1)Cc1c[nH]cn1
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.226g/mol
Monoisotopic Mass:
164.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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