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1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1)

1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1) structure

CAS No:
151257-01-1
Formula:
C11H18N2O.ClH
Chemical Name:
1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1)
Synonyms:
1,3-Diazaspiro[4.4]non-1-en-4-one,2-butyl-,hydrochloride (1:1);1,3-Diazaspiro[4.4]non-1-en-4-one,2-butyl-,monohydrochloride;2-Butyl-1,3-diazaspiro[4.4]non-1-en-4-one hydrochloride
Categories:
Pharmaceutical Intermediates > Cardiovascular Agents

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Description

Oil

1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1) Basic Attributes

Molecular Weight：

230.73

Exact Mass：

230.118591

EC Number：

424-560-4

DSSTox ID：

DTXSID10436477

HScode：

2933990090

Characteristics

PSA：

41.5

XLogP3：

2.58410

Appearance：

white or pale white crystal powder

Boiling Point：

328.6ºC at 760mmHg

Flash Point：

152.6ºC

Vapor Pressure：

0.000135mmHg at 25°C

Safety Information

Precautionary statement(s)：

P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 6 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1) Use and Manufacturing

2-Butyl-1,3-diazaspiro[4.4]non-1-en-4-one is an intermediate of Irbesartan (Avapro) (I751000).

Computed Properties

Molecular Weight:230.73
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:230.1185909
Monoisotopic Mass:230.1185909
Topological Polar Surface Area:41.5
Heavy Atom Count:15
Complexity:265
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Recommended Suppliers of 1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1)

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2-Butyl-4-spirocyclopentane-2-imidazolin-5-one hydrochloride

CAS No.: 151257-01-1

Content: 99.00%

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2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one hydrochloride

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CAS No.: 151257-01-1

Grade: Pharmaceutical Grade

Content: 99%

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Guide of 1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1)

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-, hydrochloride (1:1)

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