1-Pyrrolidinebutanenitrile
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1-Pyrrolidinebutanenitrile
structure -
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CAS No:
35543-25-0
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Formula:
C8H14N2
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Chemical Name:
1-Pyrrolidinebutanenitrile
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Synonyms:
1-Pyrrolidinebutanenitrile;1-Pyrrolidinebutyronitrile;4-Pyrrolidinobutyronitrile;4-(1-Pyrrolidinyl)butyronitrile;4-(Pyrrolidin-1-yl)butanenitrile
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CAS No:
Characteristics
27.03000
1.32388
clear liquid
0.926 g/mL at 25 °C (lit.)
115 °C @ Press: 18 Torr
99ºC
n20/D 1.46(lit.)
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
9.93±0.20
Safety Information
I; II; III
IRRITANT
3276
3
20/21/22-36/37/38
26-37/39-36/37/39-36
UY0270000
Xn
Stable under normal temperatures and pressures.
P261; P280; P305 + P351 + P338
H302; H312; H315; H319; H332; H335
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:138.21
XLogP3:0.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:138.115698455
Monoisotopic Mass:138.115698455
Topological Polar Surface Area:27
Heavy Atom Count:10
Complexity:127
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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