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2-Nitrobutane

2-Nitrobutane structure

CAS No:
600-24-8
Formula:
C4H9NO2
Chemical Name:
2-Nitrobutane
Synonyms:
Butane,2-nitro-;2-Nitrobutane;NSC 17664;116781-85-2

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2-Nitrobutane Basic Attributes

Molecular Weight：

103.121

Exact Mass：

103.12

EC Number：

209-989-5

NSC Number：

17664

DSSTox ID：

DTXSID3020968

Characteristics

PSA：

45.8

XLogP3：

1.58480

Density：

0.9854 g/cm³ @ Temp: 17 °C

Melting Point：

<25 °C

Boiling Point：

139.5 °C

Flash Point：

38.1ºC

Refractive Index：

1.407

Vapor Pressure：

7.79 mmHg

Safety Information

Precautionary statement(s)：

P264, P270, P280, P301+P310, P305+P351+P338, P310, P321, P330, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P305+P351+P338, P310, P321, P330, 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.

Drug Information

MeSH Entry Terms：

2-Nitrobutane

Computed Properties

Molecular Weight:103.12
XLogP3:1.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:103.063328530
Monoisotopic Mass:103.063328530
Topological Polar Surface Area:45.8
Heavy Atom Count:7
Complexity:66.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Nitrobutane

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

2-Nitrobutane

SDS

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