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71736-20-4 | Tridecanoic acid, 13-iodo-
CAS No: 71736-20-4 Catalog No: AG0062GZ MDL No:
Product Description
Catalog Number:
AG0062GZ
Chemical Name:
Tridecanoic acid, 13-iodo-
CAS Number:
71736-20-4
Molecular Formula:
C13H25IO2
Molecular Weight:
340.2409
IUPAC Name:
13-iodotridecanoic acid
InChI:
InChI=1S/C13H25IO2/c14-12-10-8-6-4-2-1-3-5-7-9-11-13(15)16/h1-12H2,(H,15,16)
InChI Key:
ORYSZIOQZCKRGV-UHFFFAOYSA-N
SMILES:
ICCCCCCCCCCCCC(=O)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
340.245g/mol
Monoisotopic Mass:
340.09g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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