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Tris(2-cyanoethyl)nitromethane

Tris(2-cyanoethyl)nitromethane structure

CAS No:
1466-48-4
Formula:
C10H12N4O2
Chemical Name:
Tris(2-cyanoethyl)nitromethane
Synonyms:
Heptanedinitrile,4-(2-cyanoethyl)-4-nitro-;4-(2-Cyanoethyl)-4-nitroheptanedinitrile;Tris(2-cyanoethyl)nitromethane;NSC 680512;4-(2-Cyanoethyl)-4-nitro-1,7-heptanedinitrile

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Tris(2-cyanoethyl)nitromethane Basic Attributes

Molecular Weight：

220.23

Exact Mass：

220.23

EC Number：

215-983-3

UNII：

E352DQR73S

NSC Number：

680512

DSSTox ID：

DTXSID70163414

HScode：

2926909090

Characteristics

PSA：

117.19000

XLogP3：

2.43644

Density：

1.18g/cm3

Melting Point：

114 °C

Boiling Point：

514.6ºC at 760mmHg

Flash Point：

265ºC

Refractive Index：

1.491

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R20/21/22

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H312-H315-H319-H332-H335

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, P403+P233, P405, 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.

Computed Properties

Molecular Weight:220.23
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:220.09602564
Monoisotopic Mass:220.09602564
Topological Polar Surface Area:117
Heavy Atom Count:16
Complexity:333
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Tris(2-cyanoethyl)nitromethane

Basic Attributes
Characteristics
Safety Information
Computed Properties

Tris(2-cyanoethyl)nitromethane

SDS

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