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(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate

(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate structure

CAS No:
2978-11-2
Formula:
C14H21N3O3
Chemical Name:
(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate
Synonyms:
Carbamimidic acid,N,N′-bis(1-methylethyl)-,(4-nitrophenyl)methyl ester;Pseudourea,1,3-diisopropyl-2-(p-nitrobenzyl)-;(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate;O-p-Nitrobenzyl-N,N′-diisopropylisourea
Categories:
Analytical Chemistry > Liquid Chromatography

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(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate Basic Attributes

Molecular Weight：

279.33

Exact Mass：

279.33

EC Number：

221-027-6

Characteristics

PSA：

79.4

XLogP3：

3.58

Density：

1.1±0.1 g/cm3

Melting Point：

42 °C

Boiling Point：

465.1±28.0 °C at 760 mmHg

Flash Point：

235.1±24.0 °C

Refractive Index：

1.534

Storage Conditions：

2-8°C

Vapor Pressure：

7.94E-09mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

UN 2811 6.1/PG 2

wgk germany：

hazard class code：

23/24/25

safety instructions：

36/37/39-45

Marks：

Precautionary statement(s)：

P261-P280-P301 + P310-P311

Hazard Statements：

H301-H311-H331

GHS Classification：

|Danger|H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-nitrobenzyl 8

(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate Use and Manufacturing

Manufacturing Info：

Carbamimidic acid, N,N'-bis(1-methylethyl)-, (4-nitrophenyl)methyl ester: ACTIVE

Computed Properties

Molecular Weight:279.33
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:279.15829154
Monoisotopic Mass:279.15829154
Topological Polar Surface Area:79.4
Heavy Atom Count:20
Complexity:329
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

(4-Nitrophenyl)methyl N,N′-bis(1-methylethyl)carbamimidate

SDS

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