OCTANOIC-1,2,3,4-13C4 ACID
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OCTANOIC-1,2,3,4-13C4 ACID
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CAS No:
159118-65-7
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Formula:
C8H16O2
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Chemical Name:
OCTANOIC-1,2,3,4-13C4 ACID
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Synonyms:
OCTANOIC-1,2,3,4-13C4 ACID;OCTANOIC ACID (1,2,3,4-13C4);OCTANOIC-1,2,3,4-13C4 ACID, 99 ATOM % 13 C;caprylic acid-1,2,3,4-13c4;13C Labeled octanoic acid
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CAS No:
Characteristics
37.30000
2.43150
0.929 g/mL at 25 °C
16 °C(lit.)
237 °C(lit.)
>230 °F(lit.)
n 20/D 1.428(lit.)
Computed Properties
Molecular Weight:148.18
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:148.12844909
Monoisotopic Mass:148.12844909
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:89.3
Isotope Atom Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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