3,3,3-trifluoro-2-(pyrrolidin-2-ylmethyl)propanoic acid
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3,3,3-trifluoro-2-(pyrrolidin-2-ylmethyl)propanoic acid
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CAS No:
480438-82-2
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Formula:
C8H12F3NO2
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Chemical Name:
3,3,3-trifluoro-2-(pyrrolidin-2-ylmethyl)propanoic acid
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Synonyms:
PC4654;
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CAS No:
3,3,3-trifluoro-2-(pyrrolidin-2-ylmethyl)propanoic acid Basic Attributes
211.18200
211.08201311
DTXSID10394169
2933990090
Safety Information
Xi
|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:211.18
XLogP3:-0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:211.08201311
Monoisotopic Mass:211.08201311
Topological Polar Surface Area:49.3
Heavy Atom Count:14
Complexity:217
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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