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Isopilocarpine hydrochloride

Isopilocarpine hydrochloride structure

CAS No:
28958-85-2
Formula:
C11H16N2O2.ClH
Chemical Name:
Isopilocarpine hydrochloride
Synonyms:
2(3H)-Furanone,3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-,monohydrochloride,(3R,4R)-;3-Isopilocarpine,monohydrochloride;2(3H)-Furanone,3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-,monohydrochloride,(3R-trans)-;Isopilocarpine hydrochloride;NSC 117178

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Isopilocarpine hydrochloride Basic Attributes

Molecular Weight：

244.71800

Exact Mass：

244.0978555 g/mol

EC Number：

249-338-2

NSC Number：

117178

Characteristics

PSA：

44.12000

XLogP3：

1.96380

Boiling Point：

431.8ºC

Flash Point：

215ºC

Vapor Pressure：

1.16E-07mmHg at 25°C

Safety Information

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Isopilocarpine hydrochloride Use and Manufacturing

Manufacturing Info：

2(3H)-Furanone, 3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-, hydrochloride (1:1), (3S,4R)-: INACTIVE

Computed Properties

Molecular Weight:244.72
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:244.0978555
Monoisotopic Mass:244.0978555
Topological Polar Surface Area:44.1
Heavy Atom Count:16
Complexity:245
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Isopilocarpine hydrochloride

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

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