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Home > Encyclopedia > [(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate

[(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate

[(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate structure

[(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate 

structure
  • CAS No:

    36016-39-4

  • Formula:

    C14H21NO5S

  • Chemical Name:

    [(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate

  • Synonyms:

    Benzenesulfonic acid,2,4,6-trimethyl-,[(1,1-dimethylethoxy)carbonyl]azanyl ester;Carbamic acid,[[(2,4,6-trimethylphenyl)sulfonyl]oxy]-,1,1-dimethylethyl ester;Carbamic acid,hydroxy-,tert-butyl ester,2-mesitylenesulfonate;[(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate;N-tert-Butoxycarbonyl-O-(mesitylsulfonyl)hydroxylamine;NSC 620029;1,1-Dimethylethyl [[(2,4,6-trimethylphenyl)sulfonyl]oxy]carbamate;tert-Butyl (((mesityl)sulfonyl)oxy)carbamate;[(2-Methylpropan-2-yl)oxycarbonylamino] 2,4,6-trimethylbenzenesulfonate

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

[(1,1-Dimethylethoxy)carbonyl]azanyl 2,4,6-trimethylbenzenesulfonate Basic Attributes

315.38500

315.39

252-837-8

620029

DTXSID20189588

2924299090

Characteristics

90.08000

4.22850

1.191g/cm3

104-105.5 °C

1.515

Safety Information

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:315.39
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:315.11404394
Monoisotopic Mass:315.11404394
Topological Polar Surface Area:90.1
Heavy Atom Count:21
Complexity:451
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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