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16424-31-0

16424-31-0 | Tetradecanoic acid, 5-oxo-

CAS No: 16424-31-0 Catalog No: AG001UQA MDL No:

Product Description

Catalog Number:
AG001UQA
Chemical Name:
Tetradecanoic acid, 5-oxo-
CAS Number:
16424-31-0
Molecular Formula:
C14H26O3
Molecular Weight:
242.3544
IUPAC Name:
5-oxotetradecanoic acid
InChI:
InChI=1S/C14H26O3/c1-2-3-4-5-6-7-8-10-13(15)11-9-12-14(16)17/h2-12H2,1H3,(H,16,17)
InChI Key:
KGKVVLCMDWQMOR-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)CCCC(=O)O
EC Number:
240-475-3
UNII:
BK78MM4X6P

Properties

Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.188g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.359g/mol
Monoisotopic Mass:
242.188g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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