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36455-72-8

36455-72-8 structural image
Product Name: ALPHA-ZEARALENOL
Formula: C18H24O5
Synonyms: 2,4-Dihydroxy-6-(6α,10-dihydroxy-trans-1-undecenyl)benzoic acid μ-lactone;2,4-Dihydroxy-6-(6α,10-dihydroxy-trans-1-undecenyl)benzoic acid μ-lactone solution
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 173 Ų [M-H]- [CCS Type: TW, Method: calibrated with polyalanine]

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Health Hazard
GHS08
GHS Hazard Statements H314:Skin corrosion/irritation
H351:Carcinogenicity
H371:Specific target organ toxicity, single exposure
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 320.4 g/mol
XLogP3 4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 320.16237386 g/mol
Monoisotopic Mass 320.16237386 g/mol
Topological Polar Surface Area 87 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 408
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Alpha-Zearalenol is a macrolide.