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Nitromethane-d3

Nitromethane-d3 structure

CAS No:
13031-32-8
Formula:
CD3NO2
Chemical Name:
Nitromethane-d3
Synonyms:
Methane-d3,nitro-;Nitromethane-d3;Trideuterionitromethane;Perdeuteronitromethane;Perdeuterionitromethane;Trideuteronitromethane
Categories:
Chemical Reagents > Deuterated Reagents

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Description

colourless liquid

Nitromethane-d3 Basic Attributes

Molecular Weight：

64.06

Exact Mass：

61.016376

EC Number：

235-892-2

DSSTox ID：

DTXSID90156449

HScode：

28459000

Characteristics

PSA：

45.8

XLogP3：

-0.19

Appearance：

Colorless Liquid

Density：

1.1672 g/cm³ @ Temp: 25 °C

Melting Point：

-29°C

Boiling Point：

100 °C(lit.)

Flash Point：

95 °F

Refractive Index：

n 20/D 1.3795(lit.)

Water Solubility：

117g/l

Storage Conditions：

Flammables area

Vapor Pressure：

78.6mmHg at 25°C

Explosive limit：

7.1-63%(V)

Safety Information

Packing level：

Hazard category：

Transport codes：

UN 1261 3/PG 2

wgk germany：

hazard class code：

5-10-22-2005/10/22

safety instructions：

Marks：

Stability/Shelf Life：

May detonate if sensitized by amines, alkalies. Incompatible with amines, strong acids, strong bases, strong oxidizing agents, strong reducing agents, copper, copper alloys,

Precautionary statement(s)：

P210-P261-P280-P304 + P340 + P312-P370 + P378-P403 + P233

Hazard Statements：

H226-H302-H331-H351

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 45 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:64.059
XLogP3:0.1
Hydrogen Bond Acceptor Count:2
Exact Mass:64.035208576
Monoisotopic Mass:64.035208576
Topological Polar Surface Area:45.8
Heavy Atom Count:4
Complexity:27.5
Isotope Atom Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 13031-32-8

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CN
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CAS No.: 13031-32-8

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