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139199-56-7

139199-56-7 | 2-Dodecanone, 1-hydroxy-

CAS No: 139199-56-7 Catalog No: AG001AH6 MDL No:

Product Description

Catalog Number:
AG001AH6
Chemical Name:
2-Dodecanone, 1-hydroxy-
CAS Number:
139199-56-7
Molecular Formula:
C12H24O2
Molecular Weight:
200.3178
IUPAC Name:
1-hydroxydodecan-2-one
InChI:
InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-12(14)11-13/h13H,2-11H2,1H3
InChI Key:
TWYQAHCTMPZAEF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC(=O)CO

Properties

Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.178g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.322g/mol
Monoisotopic Mass:
200.178g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

Literature

Title Journal
Cytotoxic compounds of Schizolaena hystrix from the Madagascar rainforest. Planta medica 20061001

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