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BETA,2-DINITROSTYRENE

BETA,2-DINITROSTYRENE structure

CAS No:
5670-67-7
Formula:
C8H6N2O4
Chemical Name:
BETA,2-DINITROSTYRENE
Synonyms:
beta,2-Dinitrostyrene;Benzene, 1-nitro-2-(2-nitroethenyl)-;1-nitro-2-(2-nitroethenyl)benzene;Maybridge1_006908;2-nitro-beta-nitrostyrene;ACMC-1ARR2;SCHEMBL4307048;CTK5A5598;ACT10927;AKOS028109871
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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BETA,2-DINITROSTYRENE Basic Attributes

Molecular Weight：

194.14

Exact Mass：

194.03300

Characteristics

PSA：

91.6

XLogP3：

2.88860

Density：

1.401g/cm3

Melting Point：

106-108 °C(lit.)

Boiling Point：

356.6ºC at 760 mmHg

Flash Point：

183.3ºC

Refractive Index：

1.642

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:194.14
XLogP3:1.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:194.03275668
Monoisotopic Mass:194.03275668
Topological Polar Surface Area:91.6
Heavy Atom Count:14
Complexity:253
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes