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100536-94-5 | 1-Undecanol, 2,11-dimercapto-
CAS No: 100536-94-5 Catalog No: AG00029U MDL No:
Product Description
Catalog Number:
AG00029U
Chemical Name:
1-Undecanol, 2,11-dimercapto-
CAS Number:
100536-94-5
Molecular Formula:
C11H24OS2
Molecular Weight:
236.4377
IUPAC Name:
2,11-bis(sulfanyl)undecan-1-ol
InChI:
InChI=1S/C11H24OS2/c12-10-11(14)8-6-4-2-1-3-5-7-9-13/h11-14H,1-10H2
InChI Key:
BUBSDHUORWWPLY-UHFFFAOYSA-N
SMILES:
SCCCCCCCCCC(CO)S
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.127g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
236.432g/mol
Monoisotopic Mass:
236.127g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
22.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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