N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea]
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![N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea] structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/59ae7cc3ff2f484189ad1bcbe017dafd.png "N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea]")
N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea]
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CAS No:
39072-70-3
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Formula:
C22H30N4O2
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Chemical Name:
N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea]
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Synonyms:
Urea,N,N′′-1,6-hexanediylbis[N′-(phenylmethyl)-;N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea];1-Benzyl-3-[6-(benzylcarbamoylamino)hexyl]urea;1,1′-hexamethylenebis(3-benzylurea);1-Benzyl-3-[6-(3-benzyl-ureido)-hexyl]-urea
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CAS No:
N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea] Basic Attributes
382.5
382.50
254-274-3
DTXSID1074622
Characteristics
82.26000
5.10920
1?+-.0.06 g/cm3
224-226 °C @ Solvent: Ethanol
675.5±55.0 °C(Predicted)
13.33±0.46
Safety Information
|Warning|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 238 companies from 3 notifications to the ECHA C&L Inventory.
N,N′′-1,6-Hexanediylbis[N′-(phenylmethyl)urea] Use and Manufacturing
Paint additives and coating additives not described by other categories
Paints and coatings
100,000 - 500,000 lb
Paint and coating manufacturing|Urea, N,N''-1,6-hexanediylbis[N'-(phenylmethyl)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:382.5
XLogP3:2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:11
Exact Mass:382.23687621
Monoisotopic Mass:382.23687621
Topological Polar Surface Area:82.3
Heavy Atom Count:28
Complexity:392
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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