Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)
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![Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bd0c71b18d9945dfa6287abe5d82ada7.png "Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)")
Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)
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CAS No:
156329-62-3
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Formula:
C8H9NO2
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Chemical Name:
Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)
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Synonyms:
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate;156329-62-3;Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester;ZINC38759665;Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI);GS-8010;SB11720;KS-000004H0;CS-0039054;methyl 1-cyanobicyclo[1.1.1]pentane-3-carboxylate
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CAS No:
Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI) Basic Attributes
151.16256
151.063
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:151.16
XLogP3:0.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:151.063328530
Monoisotopic Mass:151.063328530
Topological Polar Surface Area:50.1
Heavy Atom Count:11
Complexity:253
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)
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Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI)
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