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3-nitro-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1,2,4-triazole

3-nitro-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1,2,4-triazole structure

CAS No:
73118-37-3
Formula:
C17H24N4O4S
Chemical Name:
3-nitro-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1,2,4-triazole
Synonyms:
3-nitro-1-(2,4,6-triisopropylbenzenesulfonyl)-1,2,4-triazole; 2,4,6-triisopropyl benzenesulfonyl 3-nitro 1,2,4-triazole; 1-(2,4,6-Tri-isopropyl-benzolsulfonyl)-3-nitro-1,2,4-triazol; TPSNI; 3-Nitro-1-[[2,4,6-tris(isopropyl)phenyl]sulfonyl]-1H-1,2,4-triazole; 1-(2,4,6-triizopropylbenzenesulfonyl)-3-nitro-1,2,4-triazole; 1-(2,4,6-triisopropylbenzenesulfonyl)-3-nitro-1,2,4-triazole; 1-(2,4,6-tri-isopropylbenzenesulphonyl)-3-nitro-1,2,4-triazole; 1-(2,4,6-Triisopropylbenzenesulfonyl)-3-nitro-1H-1,2,4-triazole; 3-nitro-1-(2,4,6-triisopropyl-benzenesulfonyl)-1H-[1,2,4]triazole;Expand

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3-nitro-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1,2,4-triazole Basic Attributes

Molecular Weight：

380.46200

Exact Mass：

380.15182643 g/mol

DSSTox ID：

DTXSID60347701

Characteristics

PSA：

119.05000

XLogP3：

5.39750

Density：

1.31g/cm3

Melting Point：

128-130ºC(lit.)

Boiling Point：

523.9ºC at 760 mmHg

Flash Point：

270.7ºC

Refractive Index：

1.607

Storage Conditions：

-20ºC

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36

Marks：

Precautionary statement(s)：

P261; P305 + P351 + P338

Hazard Statements：

H315; H319; H335

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:380.5
XLogP3:4.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:380.15182643
Monoisotopic Mass:380.15182643
Topological Polar Surface Area:119
Heavy Atom Count:26
Complexity:579
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: r thioctic acid; calcium sulfite; n2o4 lewis structure; formula for nitrous acid; bioglutide; mno2

Guide of 3-nitro-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1,2,4-triazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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