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7296-94-8 | 2-Dodecanol, 1-[(2-hydroxyethyl)sulfinyl]-
CAS No: 7296-94-8 Catalog No: AG005D0X MDL No:
Product Description
Catalog Number:
AG005D0X
Chemical Name:
2-Dodecanol, 1-[(2-hydroxyethyl)sulfinyl]-
CAS Number:
7296-94-8
Molecular Formula:
C14H30O3S
Molecular Weight:
278.4512
IUPAC Name:
1-(2-hydroxyethylsulfinyl)dodecan-2-ol
InChI:
InChI=1S/C14H30O3S/c1-2-3-4-5-6-7-8-9-10-14(16)13-18(17)12-11-15/h14-16H,2-13H2,1H3
InChI Key:
KZZFYSQYGOONTO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC(CS(=O)CCO)O
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.192g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
278.451g/mol
Monoisotopic Mass:
278.192g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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