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Merck
CN

443050

Sigma-Aldrich

N-(tert-Butoxycarbonyl)-2-aminoacetonitrile

97%

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About This Item

Linear Formula:
(CH3)3COCONHCH2CN
CAS Number:
85363-04-8
Molecular Weight:
156.18
MDL number:
MFCD00239390
UNSPSC Code:
12352100
PubChem Substance ID:
24868044
NACRES:
NA.22

Key Documents

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Assay

97%

form

solid

bp

186 °C (lit.)

mp

53-57 °C (lit.)

functional group

amine
nitrile

SMILES string

CC(C)(C)OC(=O)NCC#N

InChI

1S/C7H12N2O2/c1-7(2,3)11-6(10)9-5-4-8/h5H2,1-3H3,(H,9,10)

InChI key

SMZKPZXYDDZDJG-UHFFFAOYSA-N

General description

N-(tert-Butoxycarbonyl)-2-aminoacetonitrile is an organic building block.

Application

N-(tert-Butoxycarbonyl)-2-aminoacetonitrile may be used for the preparation of N-(tert-butoxycarbonyl)-2-aminoacetamidoxime, by reaction with hydroxylamine hydrochloride.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302 + H312 + H332

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCJ1868
MKBH8157V
MKBC2504
MKBB1408
01016EH

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A convenient large scale synthesis of N-Boc-ethylenediamine.
Ravikumar VT.
Synthetic Communications, 24(12), 1767-1772 (1994)

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