1-Pyrrolidinecarbonitrile
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1-Pyrrolidinecarbonitrile
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CAS No:
1530-88-7
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Formula:
C5H8N2
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Chemical Name:
1-Pyrrolidinecarbonitrile
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Synonyms:
1-Pyrrolidinecarbonitrile;Tetramethylenecyanamide;1-Cyanopyrrolidine;N-Cyanopyrrolidine;Pyrrolidinocarbonitrile;1-Pyrrolidinylcyanamide;NSC 44225;1-Pyrrolidinecyanamide
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CAS No:
Characteristics
27.03000
0.50118
0.954 g/mL at 25 °C(lit.)
196 - 198ºC
107-110 °C @ Press: 17 Torr
225 °F
n 20/D 1.469(lit.)
0.0498mmHg at 25°C
Safety Information
III
6.1
3276
3
R20/21/22
36
Xn
P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501
H301+H311+H331
|Danger|H301+H311+H331 (100%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, 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:96.13
XLogP3:1
Hydrogen Bond Acceptor Count:2
Exact Mass:96.068748264
Monoisotopic Mass:96.068748264
Topological Polar Surface Area:27
Heavy Atom Count:7
Complexity:93.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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