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Home > Encyclopedia > 1,3-DI-BOC-2-METHYLISOTHIOUREA

1,3-DI-BOC-2-METHYLISOTHIOUREA

1,3-DI-BOC-2-METHYLISOTHIOUREA structure

1,3-DI-BOC-2-METHYLISOTHIOUREA 

structure
  • CAS No:

    107819-90-9

  • Formula:

    C12H22N2O4S

  • Chemical Name:

    1,3-DI-BOC-2-METHYLISOTHIOUREA

  • Synonyms:

    N,N'-DI-BOC-S-METHYLISOTHIOUREA;N,N'-BIS(TERT-BUTOXYCARBONYL)-S-METHYLISOTHIOUREA;1,3-DI-BOC-2-METHYLISOTHIOUREA;1,3-BIS(TERT-BUTOXYCARBONYL)-2-METHYL-2-THIOPSEUDOUREA;1,3-bis(tert-butoxycarbonyl)-2-methyl-2-thiopseud;1,3-Di-Boc-2-methylisothiourea,N,Nμ-Di-Boc-S-methylisothiourea,N,Nμ-Bis(tert-butoxycarbonyl)-S-methylisothiourea;1,3-Di-Boc-2-methylisothiourea,N,Nμ-Bis(tert-butoxycarbonyl)-S-methylisothiourea;1,3-Bis(tert-butoxycarbonyl)-2-methyl-2-thiopseudourea,95%

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

White crystalline powder

1,3-DI-BOC-2-METHYLISOTHIOUREA Basic Attributes

290.38

290.130035

29309090

Characteristics

102 Ų

1.10±0.1 g/cm3(Predicted)

115-121 °C(lit.)

1.492

Safety Information

3

24/25

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 4 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1,3-DI-BOC-2-METHYLISOTHIOUREA Use and Manufacturing

Reagent for the guanylation of amines.

Computed Properties

Molecular Weight:290.38
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:290.13002836
Monoisotopic Mass:290.13002836
Topological Polar Surface Area:102
Heavy Atom Count:19
Complexity:367
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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