2-Amino-1,3-octadecanediol
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2-Amino-1,3-octadecanediol
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CAS No:
13552-09-5
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Formula:
C18H39NO2
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Chemical Name:
2-Amino-1,3-octadecanediol
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Synonyms:
1,3-Octadecanediol,2-amino-;2-Amino-1,3-octadecanediol;DL-Sphinganine;2-Aminooctadecane-1,3-diol;1,3-Dihydroxy-2-amino-octadecane
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CAS No:
Description
2-aminooctadecane-1,3-diol is an aminodiol that is octadecane bearing two hydroxy substituents at positions 1 and 3 as well as an amino substituent at position 2. It is a sphingoid and an aminodiol.
Safety Information
3
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory.
Drug Information
Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)
2-aminooctadecane-1,3-diol
Computed Properties
Molecular Weight:301.5
XLogP3:5.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:16
Exact Mass:301.298079487
Monoisotopic Mass:301.298079487
Topological Polar Surface Area:66.5
Heavy Atom Count:21
Complexity:200
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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