(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
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![(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/dd6b6d0d68ad4ba88a7857f2b1103b2b.png "(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine")
(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
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CAS No:
131180-63-7
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Formula:
C21H27NO
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Chemical Name:
(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
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Synonyms:
(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine;(S)-α,α-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol;(S)-α,α-Bis(3,5-diMethylphenyl)-2-pyrrolidineMethanol >=99% (HPLC);(S)-alpha,alpha-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol >=99% (HPLC);(S)-α,α-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol,99%e.e.;(S)-Bis(3,5-dimethylphenyl)(pyrrolidin-2-yl)methanol;2-Pyrrolidinemethanol, α,α-bis(3,5-dimethylphenyl)-, (2S)-;(S)-alpha,alpha-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol
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CAS No:
(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine Basic Attributes
309.45
309.209264485
DTXSID50469527
Safety Information
UN 2811 6.1/PG 3
3
22-50/53
60-61
Xn,N
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, P391, 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:309.4
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:309.209264485
Monoisotopic Mass:309.209264485
Topological Polar Surface Area:32.3
Heavy Atom Count:23
Complexity:349
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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