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7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride

7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride structure

CAS No:
313505-85-0
Formula:
C24H32N4O7.2HCl
Chemical Name:
7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride
Synonyms:
7,13-bis(4-nitrobenzyl)-1,4,10-trioxa-7,13-diazacyclopentadecane;VU590;VU 590 dihydrochloride;VU590 HCl;1783987-83-6;ML111;7,13-bis(4-nitrobenzyl)-1,4,10-trioxa-7,13-diazacyclopentadecane, dihydrochloride;VU590 dihydrochloride;7,13-bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecane

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7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride Basic Attributes

Molecular Weight：

561.45536

Exact Mass：

560.18

DSSTox ID：

DTXSID90849485

Characteristics

PSA：

126

Density：

1.216±0.06 g/cm3(Predicted)

Storage Conditions：

Desiccate at +4°C

Safety Information

Precautionary statement(s)：

P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

7,13-bis(4-nitrobenzyl)-1,4,10-trioxa-7,13-diazacyclopentadecane

Computed Properties

Molecular Weight:561.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:560.1804548
Monoisotopic Mass:560.1804548
Topological Polar Surface Area:126
Heavy Atom Count:37
Complexity:562
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

7,13-Bis[(4-nitrophenyl)methyl]-1,4,10-trioxa-7,13-diazacyclopentadecanedihydrochloride

SDS

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