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26901-96-2 | 2-HYDROXYETHYL N-PENTYL SULPHIDE, 95
CAS No: 26901-96-2 Catalog No: AG003HFK MDL No:
Product Description
Catalog Number:
AG003HFK
Chemical Name:
2-HYDROXYETHYL N-PENTYL SULPHIDE, 95
CAS Number:
26901-96-2
IUPAC Name:
2-pentylsulfanylethanol
InChI:
InChI=1S/C7H16OS/c1-2-3-4-6-9-7-5-8/h8H,2-7H2,1H3
InChI Key:
GMCYCIFSAJJFSY-UHFFFAOYSA-N
NSC Number:
84164
Properties
Complexity:
48.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.092g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.264g/mol
Monoisotopic Mass:
148.092g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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