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4999-79-5

4999-79-5 structural image
Product Name: 17β-Estradiol 3-O-Sulfate SodiuM Salt
Formula: C18H23NaO5S
Synonyms: 1,3,5(10)-Estratriene-3,17β-diol 3-sulfate;3,17β-Dihydroxy-1,3,5(10)-estratriene 3-sulfate
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
GHS Hazard Statements H351:Carcinogenicity
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 374.4 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 374.11638929 g/mol
Monoisotopic Mass 374.11638929 g/mol
Topological Polar Surface Area 95 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 591
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes