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6-NITRO-1-HEXENE,97

6-NITRO-1-HEXENE,97 structure

CAS No:
4812-17-3
Formula:
C6H11NO2
Chemical Name:
6-NITRO-1-HEXENE,97
Synonyms:
6-Nitro-1-hexene;6-nitrohex-1-ene;1-Hexene, 6-nitro-;1-nitrohex-5-ene;SCHEMBL816964;CTK1D5248;DTXSID80336556;ZINC2557923;MFCD00209606;AKOS006227672

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6-NITRO-1-HEXENE,97 Basic Attributes

Molecular Weight：

129.15700

Exact Mass：

129.07900

DSSTox ID：

DTXSID80336556

Characteristics

PSA：

45.82000

XLogP3：

2.14260

Density：

0.97 g/mL at 25ºC(lit.)

Boiling Point：

195ºC(lit.)

Flash Point：

165 °F

Refractive Index：

n20/D 1.444(lit.)

Safety Information

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36

Marks：

Xn: Harmful;

Precautionary statement(s)：

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, P501

Hazard Statements：

H302

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:129.16
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:129.078978594
Monoisotopic Mass:129.078978594
Topological Polar Surface Area:45.8
Heavy Atom Count:9
Complexity:95.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-NITRO-1-HEXENE,97

Basic Attributes
Characteristics
Safety Information
Computed Properties

6-NITRO-1-HEXENE,97

SDS

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