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2-[1-(cyanomethyl)cyclopropyl]acetonitrile

2-[1-(cyanomethyl)cyclopropyl]acetonitrile structure

CAS No:
20778-47-6
Formula:
C7H8N2
Chemical Name:
2-[1-(cyanomethyl)cyclopropyl]acetonitrile
Synonyms:
(1-cyanomethylcyclopropyl)acetonitrile; 1,1-cyclopropanediacetonitrile; 1,1-bis(cyanomethyl)cyclopropane; 1,1-Bis-cyanmethyl-cyclopropan; cyclopropane-1,1-diacetonitrile; 2,2'-(Cyclopropane-1,1-diyl)diacetonitrile; 1,1-Di-(cyanomethyl)cyclopropan;Expand
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-[1-(cyanomethyl)cyclopropyl]acetonitrile Basic Attributes

Molecular Weight：

120.15200

Exact Mass：

120.068748264

DSSTox ID：

DTXSID00501522

HScode：

2926909090

Characteristics

PSA：

47.58000

XLogP3：

1.59396

Density：

1.057

Boiling Point：

298ºC

Flash Point：

149ºC

Refractive Index：

1.4578

Vapor Pressure：

0.00132mmHg at 25°C

Safety Information

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:120.15
XLogP3:0.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:120.068748264
Monoisotopic Mass:120.068748264
Topological Polar Surface Area:47.6
Heavy Atom Count:9
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[1-(cyanomethyl)cyclopropyl]acetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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