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IsopropylTetrazole

IsopropylTetrazole structure

CAS No:
6280-28-0
Formula:
C4H8N4
Chemical Name:
IsopropylTetrazole
Synonyms:
5-isopropyl-1H-tetrazole;5-(propan-2-yl)-1H-1,2,3,4-tetrazole;ISOPROPYL TETRAZOLE;2H-Tetrazole,5-(1-methylethyl)-;5-propan-2-yl-2H-tetrazole;i-propyltetrazole;NSC11107;5-isopropyl-2h-tetrazole;SCHEMBL266223;CTK5B6107

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IsopropylTetrazole Basic Attributes

Molecular Weight：

112.13300

Exact Mass：

112.07500

NSC Number：

11107

DSSTox ID：

DTXSID80279035

HScode：

2933990090

Characteristics

PSA：

43.60000

XLogP3：

0.25400

Density：

1.15g/cm3

Melting Point：

113-114 °C

Boiling Point：

229.2ºC at 760 mmHg

Flash Point：

102.5ºC

Refractive Index：

1.509

Safety Information

GHS Classification：

|Warning|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:112.13
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:112.074896272
Monoisotopic Mass:112.074896272
Topological Polar Surface Area:54.5
Heavy Atom Count:8
Complexity:72.4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of IsopropylTetrazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

IsopropylTetrazole

SDS

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