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4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine

4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine structure

CAS No:
214472-06-7
Formula:
C12H15N3O2
Chemical Name:
4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine
Synonyms:
4-[(tert-Butoxycarbonylamino)methyl]-2-cyanopyridine;4-(Boc-aminomethyl)-2-cyanopyridine;tert-butyl N-[(2-cyanopyridin-4-yl)methyl]carbamate;tert-butyl ((2-cyanopyridin-4-yl)methyl)carbamate;tert-Butyl [(2-cyanopyridin-4-yl)methyl]carbamate;ACMC-1CD53;SCHEMBL2392439;CTK4E6812;DTXSID60632684;ANW-24456
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

Light yellow solid

4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine Basic Attributes

Molecular Weight：

233.27

Exact Mass：

233.11600

DSSTox ID：

DTXSID60632684

HScode：

2933399090

Characteristics

PSA：

XLogP3：

2.18238

Density：

1.15g/cm3

Boiling Point：

417.3ºC at 760 mmHg

Flash Point：

206.2ºC

Refractive Index：

1.527

Vapor Pressure：

3.57E-07mmHg at 25°C

Safety Information

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:233.27
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:233.116426730
Monoisotopic Mass:233.116426730
Topological Polar Surface Area:75
Heavy Atom Count:17
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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4-[(tert-butoxycarbonylamino)methyl]-2-cyanopyridine

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