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88695-37-8 | Benzene, (1-nonynylthio)-
CAS No: 88695-37-8 Catalog No: AG0046M0 MDL No:
Product Description
Catalog Number:
AG0046M0
Chemical Name:
Benzene, (1-nonynylthio)-
CAS Number:
88695-37-8
Molecular Formula:
C15H20S
Molecular Weight:
232.3843
IUPAC Name:
non-1-ynylsulfanylbenzene
InChI:
InChI=1S/C15H20S/c1-2-3-4-5-6-7-11-14-16-15-12-9-8-10-13-15/h8-10,12-13H,2-7H2,1H3
InChI Key:
YLTIFVOVHWNBNH-UHFFFAOYSA-N
SMILES:
CCCCCCCC#CSc1ccccc1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.129g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.385g/mol
Monoisotopic Mass:
232.129g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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