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5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE

5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE structure

CAS No:
54042-97-6
Formula:
C6H9ClN2O
Chemical Name:
5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE
Synonyms:
5-(chloromethyl)-3-isopropyl-1,2,4-oxadiazole;5-(chloromethyl)-3-(propan-2-yl)-1,2,4-oxadiazole;5-chloromethyl-3-isopropyl-[1,2,4]oxadiazole;1,2,4-OXADIAZOLE, 5-(CHLOROMETHYL)-3-(1-METHYLETHYL)-;5-(chloromethyl)-3-propan-2-yl-1,2,4-oxadiazole;KSC268Q2P;SCHEMBL461807;CTK1G8827;DTXSID00541802;ALBB-012349

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5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE Basic Attributes

Molecular Weight：

160.6

Exact Mass：

160.04000

DSSTox ID：

DTXSID00541802

HScode：

2934999090

Characteristics

PSA：

38.9

XLogP3：

1.93180

Density：

1.177g/cm3

Boiling Point：

229.197ºC at 760 mmHg

Flash Point：

92.416ºC

Refractive Index：

1.479

Safety Information

Hazard category：

IRRITANT

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+H312+H332

GHS Classification：

|Danger|H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:160.60
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:160.0403406
Monoisotopic Mass:160.0403406
Topological Polar Surface Area:38.9
Heavy Atom Count:10
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE

Basic Attributes
Characteristics
Safety Information
Computed Properties

5-(CHLOROMETHYL)-3-ISOPROPYL-1,2,4-OXADIAZOLE

SDS

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