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72126-78-4

72126-78-4 structural image
Product Name: N,N'-BIS[2-[5-(DIMETHYLAMINOMETHYL)FURFURYLTHIO]ETHYL]-2-NITRO-1,1-ETHENDIAMINE
Formula: C22H35N5O4S2
Synonyms: N,N′-Bis{2-{{{5-[(dimethylamino)methyl]furan-2-yl}methyl}sulfanyl}ethyl}-2-nitroethene-1,1-diamine;N,N′-Bis{2-{{{5-[(dimethylamino)methyl]furan-2-yl}methyl}thio}ethyl}-2-nitro-1,1-ethylenediamine;N,N?-BIS{2-{{{5-[(DIMETHYLAMINO) METHYL]FURAN-2- YL}METHYL}SULFANYL}ETHYL}-2-NITROETHENE-1,1-DIAMINE;Ranitidine Impurity A
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
GHS Hazard Statements H317:Sensitisation, Skin
H334:Sensitisation, respiratory
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P284:Wear respiratory protection.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention.
P342+P311:IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 497.7 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 16
Exact Mass 497.21304696 g/mol
Monoisotopic Mass 497.21304696 g/mol
Topological Polar Surface Area 153 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 552
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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