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71173-33-6 | 7-OXOUNDECANOIC ACID
CAS No: 71173-33-6 Catalog No: AG005KLM MDL No:
Product Description
Catalog Number:
AG005KLM
Chemical Name:
7-OXOUNDECANOIC ACID
CAS Number:
71173-33-6
Molecular Formula:
C11H20O3
Molecular Weight:
200.2747
IUPAC Name:
7-oxoundecanoic acid
InChI:
InChI=1S/C11H20O3/c1-2-3-7-10(12)8-5-4-6-9-11(13)14/h2-9H2,1H3,(H,13,14)
InChI Key:
HZIZHWOQKWVNFR-UHFFFAOYSA-N
SMILES:
CCCCC(=O)CCCCCC(=O)O
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.141g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.278g/mol
Monoisotopic Mass:
200.141g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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