Heptacosanoic acid
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Heptacosanoic acid
structure -
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CAS No:
7138-40-1
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Formula:
C27H54O2
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Chemical Name:
Heptacosanoic acid
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Synonyms:
Heptacosanoic acid;Carboceric acid;Heptacosylic acid
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CAS No:
Description
ChEBI: A C27, very long straight-chain, saturated fatty acid.
Solid
Heptacosanoic acid is a C27, very long straight-chain, saturated fatty acid. It has a role as a plant metabolite. It is a very long-chain fatty acid and a straight-chain saturated fatty acid. It is a conjugate acid of a heptacosanoate.
Characteristics
37.30000
9.84340
Solid
0.876g/cm3
86.8 °C
424.7ºC at 760 mmHg
190.1ºC
1.461
204.58 Ų [M-H]- [CCS Type: TIMS, Method: single field calibrated]
Heptacosanoic acid Use and Manufacturing
Carboxylic acids, C27-47: INACTIVE
Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Straight chain fatty acids [FA0101]
Computed Properties
Molecular Weight:410.7
XLogP3:12.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:25
Exact Mass:410.412380961
Monoisotopic Mass:410.412380961
Topological Polar Surface Area:37.3
Heavy Atom Count:29
Complexity:314
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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