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3-[1-[2-(4-hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol;hydrate;hydrochloride

3-[1-[2-(4-hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol;hydrate;hydrochloride structure

CAS No:
64047-90-1
Formula:
C22H32ClNO3
Chemical Name:
3-[1-[2-(4-hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol;hydrate;hydrochloride
Synonyms:
3-{1-[2-(4-hydroxyphenyl)ethyl]-3-isobutylpyrrolidin-3-yl}phenol hydrochloride hydrate;64047-90-1;Phenol, m-(1-(p-hydroxyphenethyl)-3-isobutyl-3-pyrrolidinyl)-, hydrochloride, hydrate;DTXSID40276161;DTXSID40982255;Pyrrolidine, 1-(p-hydroxyphenethyl)-3-(m-hydroxyphenyl)-3-isobutyl-, hydrochloride, hydrate;3-{1-[2-(4-Hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl}phenol--hydrogen chloride--water (1/1/1)

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3-[1-[2-(4-hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol;hydrate;hydrochloride Basic Attributes

Molecular Weight：

393.9 g/mol

Exact Mass：

393.2070716 g/mol

DSSTox ID：

DTXSID40276161

Characteristics

PSA：

44.7 Å²

Computed Properties

Molecular Weight:393.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:393.2070716
Monoisotopic Mass:393.2070716
Topological Polar Surface Area:44.7
Heavy Atom Count:27
Complexity:405
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 3-[1-[2-(4-hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol;hydrate;hydrochloride

Basic Attributes
Characteristics
Computed Properties

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