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3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE

3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE structure

CAS No:
56112-89-1
Formula:
C9H12N4
Chemical Name:
3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE
Synonyms:
MLS002707355;3-Amino-2,4,5,6-Tetrahydrocyclopentapyrazole-2-Propionitrile;cyclopenta[c]pyrazole-2(4h)-propanenitrile, 3-amino-5,6-dihydro-;3-(3-Amino-5,6-dihydrocyclopenta[c]pyrazol-2(4H)-yl)propanenitrile;3-[3-amino-5,6-dihydrocyclopenta[c]pyrazol-2(4H)-yl]propanenitrile;NSC124135;SCHEMBL11743978;CTK5A4656;DTXSID20298548;ZINC1713354

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3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE Basic Attributes

Molecular Weight：

176.2228

Exact Mass：

176.10600

NSC Number：

124135

DSSTox ID：

DTXSID20298548

HScode：

2933990090

Characteristics

PSA：

67.6

XLogP3：

1.44888

Density：

1.36g/cm3

Boiling Point：

422.2ºC at 760 mmHg

Flash Point：

209.1ºC

Refractive Index：

1.695

Safety Information

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

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:176.22
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:176.106196400
Monoisotopic Mass:176.106196400
Topological Polar Surface Area:67.6
Heavy Atom Count:13
Complexity:231
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-AMINO-2,4,5,6-TETRAHYDROCYCLOPENTAPYRAZOLE-2-PROPIONITRILE

SDS

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