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102037-89-8 | Thiophene, 3-(4,8,12-trimethyltridecyl)-
CAS No: 102037-89-8 Catalog No: AG0006FJ MDL No:
Product Description
Catalog Number:
AG0006FJ
Chemical Name:
Thiophene, 3-(4,8,12-trimethyltridecyl)-
CAS Number:
102037-89-8
Molecular Formula:
C20H36S
Molecular Weight:
308.5648
IUPAC Name:
3-(4,8,12-trimethyltridecyl)thiophene
InChI:
InChI=1S/C20H36S/c1-17(2)8-5-9-18(3)10-6-11-19(4)12-7-13-20-14-15-21-16-20/h14-19H,5-13H2,1-4H3
InChI Key:
HCUPGGLNJFUUFZ-UHFFFAOYSA-N
SMILES:
CC(CCCc1cscc1)CCCC(CCCC(C)C)C
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.254g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.568g/mol
Monoisotopic Mass:
308.254g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
9.1
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