Home Other Building Blocks 2-hydroxyethyl n-octyl sulphide

2-hydroxyethyl n-octyl sulphide

CAS No.:
3547-33-9
Catalog Number:
AG0035ZZ
Molecular Formula:
C10H22OS
Molecular Weight:
190.3461
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Product Description
Catalog Number:
AG0035ZZ
Chemical Name:
2-hydroxyethyl n-octyl sulphide
CAS Number:
3547-33-9
Molecular Formula:
C10H22OS
Molecular Weight:
190.3461
MDL Number:
MFCD00014046
IUPAC Name:
2-octylsulfanylethanol
InChI:
InChI=1S/C10H22OS/c1-2-3-4-5-6-7-9-12-10-8-11/h11H,2-10H2,1H3
InChI Key:
KXPXKNBDCUOENF-UHFFFAOYSA-N
SMILES:
CCCCCCCCSCCO
EC Number:
222-598-4
UNII:
3G5X52121W
NSC Number:
163967
Properties
Complexity:
76.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.139g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.345g/mol
Monoisotopic Mass:
190.139g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties