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Pitofenone hydrochloride

Pitofenone hydrochloride structure

CAS No:
1248-42-6
Formula:
C22H25NO4.ClH
Chemical Name:
Pitofenone hydrochloride
Synonyms:
Benzoic acid,2-[4-[2-(1-piperidinyl)ethoxy]benzoyl]-,methyl ester,hydrochloride (1:1);Benzoic acid,o-[p-(2-piperidinoethoxy)benzoyl]-,methyl ester,hydrochloride;Benzoic acid,2-[4-[2-(1-piperidinyl)ethoxy]benzoyl]-,methyl ester,hydrochloride;4′-(β-Piperidinoethoxy)-2-(carbomethoxy)benzophenone hydrochloride;Bulgarketone;Pitofenone hydrochloride;Baralgin-Ketone;Baralgin ketone hydrochloride;Methyl 2-[4-(2-piperidinoethoxy)benzoyl]benzoate hydrochloride;100239-75-6

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Pitofenone hydrochloride Basic Attributes

Molecular Weight：

403.9

Exact Mass：

403.155

EC Number：

214-999-8

UNII：

HE1ZA4ZBEX

DSSTox ID：

DTXSID7046461

HScode：

2933399090

Characteristics

PSA：

55.8

XLogP3：

4.30880

Boiling Point：

512ºC at 760 mmHg

Flash Point：

263.4ºC

Vapor Pressure：

1.35E-10mmHg at 25°C

Safety Information

Packing level：

Ⅲ

Transport codes：

2811

hazard class code：

6.1

Precautionary statement(s)：

P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

baralginketone

Computed Properties

Molecular Weight:403.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:403.1550360
Monoisotopic Mass:403.1550360
Topological Polar Surface Area:55.8
Heavy Atom Count:28
Complexity:481
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Pitofenone hydrochloride

CAS No.: 1248-42-6

Content: 99.00%

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Guide of Pitofenone hydrochloride

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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Pitofenone hydrochloride

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