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19790-87-5 | Tridecanoic acid, 2-hydroxy-
CAS No: 19790-87-5 Catalog No: AG002B5D MDL No:
Product Description
Catalog Number:
AG002B5D
Chemical Name:
Tridecanoic acid, 2-hydroxy-
CAS Number:
19790-87-5
Molecular Formula:
C13H26O3
Molecular Weight:
230.3437
IUPAC Name:
2-hydroxytridecanoic acid
InChI:
InChI=1S/C13H26O3/c1-2-3-4-5-6-7-8-9-10-11-12(14)13(15)16/h12,14H,2-11H2,1H3,(H,15,16)
InChI Key:
KCEUZVYQPROALO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(C(=O)O)O
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.188g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.348g/mol
Monoisotopic Mass:
230.188g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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