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4-NITROBENZO-18-CROWN-6

4-NITROBENZO-18-CROWN-6 structure

CAS No:
53408-96-1
Formula:
C16H23NO8
Chemical Name:
4-NITROBENZO-18-CROWN-6
Synonyms:
4'-NITROBENZO-18-CROWN-6;4-NITROBENZO-18-CROWN-6;4'-NITROBENZO-18-CROWN 6-ETHER;2,3-(4-NITROBENZO)-1,4,7,10,13,16-HEXAOXACYCLOOCTADEC-2-ENE;NITROBENZO-18-CROWN-6;4-Nitrobenzo-18-crown-6,99%;NITROBENZO-18-CROWN-6, 99+%;1,16-(4-Nitro-1,2-phenylene)-1,4,7,10,13,16-hexaoxahexadecane
Categories:
Chemical Reagents > Organic Reagents

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Description

LIGHT YELLOW FLUFFY POWDER

4-NITROBENZO-18-CROWN-6 Basic Attributes

Molecular Weight：

357.36

Exact Mass：

357.142365

DSSTox ID：

DTXSID10345156

HScode：

29329985

Characteristics

PSA：

101

XLogP3：

0.71

Density：

1.2±0.1 g/cm3

Melting Point：

82-86 °C

Boiling Point：

515.4±50.0 °C at 760 mmHg

Flash Point：

210.2±32.1 °C

Refractive Index：

1.477

Safety Information

wgk germany：

hazard class code：

36/37/38-34-11

safety instructions：

26-36-45-36/37/39-16

Marks：

Xi,C,F

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|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 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:357.36
XLogP3:0.1
Hydrogen Bond Acceptor Count:8
Exact Mass:357.14236669
Monoisotopic Mass:357.14236669
Topological Polar Surface Area:101
Heavy Atom Count:25
Complexity:365
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes