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163045-78-1 | Thiophene, 3-cyclohexyl-4-methyl-
CAS No: 163045-78-1 Catalog No: AG001TMZ MDL No:
Product Description
Catalog Number:
AG001TMZ
Chemical Name:
Thiophene, 3-cyclohexyl-4-methyl-
CAS Number:
163045-78-1
Molecular Formula:
C11H16S
Molecular Weight:
180.3097
IUPAC Name:
3-cyclohexyl-4-methylthiophene
InChI:
InChI=1S/C11H16S/c1-9-7-12-8-11(9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
InChI Key:
UBNBPEQRHOIIMO-UHFFFAOYSA-N
SMILES:
Cc1cscc1C1CCCCC1
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.097g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.309g/mol
Monoisotopic Mass:
180.097g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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