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1578-59-2 | Octanoic acid, 2-fluoro-
CAS No: 1578-59-2 Catalog No: AG001PPZ MDL No:MFCD20649174
Product Description
Catalog Number:
AG001PPZ
Chemical Name:
Octanoic acid, 2-fluoro-
CAS Number:
1578-59-2
Molecular Formula:
C8H15FO2
Molecular Weight:
162.2019
MDL Number:
MFCD20649174
IUPAC Name:
2-fluorooctanoic acid
InChI:
InChI=1S/C8H15FO2/c1-2-3-4-5-6-7(9)8(10)11/h7H,2-6H2,1H3,(H,10,11)
InChI Key:
SASJUHYALINSSV-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(=O)O)F
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.106g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.204g/mol
Monoisotopic Mass:
162.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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