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114374-80-0 | Thiophene, tetrahydrotridecyl- (9CI)
CAS No: 114374-80-0 Catalog No: AG000B6Y MDL No:
Product Description
Catalog Number:
AG000B6Y
Chemical Name:
Thiophene, tetrahydrotridecyl- (9CI)
CAS Number:
114374-80-0
Molecular Formula:
C17H34S
Molecular Weight:
270.5169
IUPAC Name:
2-tridecylthiolane
InChI:
InChI=1S/C17H34S/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18-17/h17H,2-16H2,1H3
InChI Key:
BAOABCVPMLDHSO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC1CCCS1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.238g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.519g/mol
Monoisotopic Mass:
270.238g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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