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2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile structure

CAS No:
58632-95-4
Formula:
C13H14N2O3
Chemical Name:
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
Synonyms:
Carbonic acid,(cyanophenylmethylene)azanyl 1,1-dimethylethyl ester;Benzeneacetonitrile,α-[[[(1,1-dimethylethoxy)carbonyl]oxy]imino]-;2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile;2-(tert-Butyloxycarbonyloxyimino)-2-phenylacetonitrile;Boc-ON;NSC 328381;2-(tert.-Butoxycarbonyloxyimino)phenylacetonitrile;2-(tert-Butoxycarbonyloximino)-2-phenylacetonitrile;2-(Boc-oxyimino)-2-phenylacetonitrile;103919-55-7;115721-57-8;154920-47-5
Categories:
Biochemical Engineering > Amino Acids and Derivatives

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Description

White to off-white microcrystalline powder

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Basic Attributes

Molecular Weight：

246.26

Exact Mass：

246.26

BRN：

2217296

EC Number：

261-370-9

DSSTox ID：

DTXSID8069278

HScode：

29280090

Characteristics

PSA：

71.7 Å²

Appearance：

White to slightly beige Fine Crystalline Powder

Density：

1.1±0.1 g/cm3

Melting Point：

82-84 °C

Boiling Point：

324.1°C at 760 mmHg

Flash Point：

149.8±23.2 °C

Refractive Index：

1.513

Water Solubility：

H2O: insoluble

Storage Conditions：

2-8°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

wgk germany：

hazard class code：

36/37/38-20/21/22

safety instructions：

22-24/25-36/37/39-26-36

RTECS Number：

DA0513600

Marks：

Xn,Xi

GHS Classification：

|Danger|H301 (16.67%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Use and Manufacturing

Uses

Amino protection reagent in peptide synthesis.

Manufacturing Info：

Carbonic acid, (cyanophenylmethylene)azanyl 1,1-dimethylethyl ester: ACTIVE

Computed Properties

Molecular Weight:246.26
XLogP3:3.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:246.10044231
Monoisotopic Mass:246.10044231
Topological Polar Surface Area:71.7
Heavy Atom Count:18
Complexity:367
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

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2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

CAS No.: 58632-95-4

Content: 99.00%

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Guide of 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

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