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5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE

5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE structure

CAS No:
52600-53-0
Formula:
C9H8N2O2
Chemical Name:
5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE
Synonyms:
5-ACETYL-1,2-DIHYDRO-6-METHYL-2-OXOPYRIDINE-3-CARBONITRILE;5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE;5-ACETYL-2-OXO-6-METHYL-1,2-DIHYDROPYRIDINE-3-CARBONITRILE;BUTTPARK 17\04-66;5-ACETYL-3-CYANO-6-METHYLPYRIDIN-2(1H)-ONE;3-Pyridinecarbonitrile,5-acetyl-1,2-dihydro-6-Methyl-2-oxo-
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE Basic Attributes

Molecular Weight：

176.17

Exact Mass：

176.05900

DSSTox ID：

DTXSID50377552

HScode：

2933399090

Characteristics

PSA：

XLogP3：

1.16988

Density：

1.25g/cm3

Melting Point：

233-235°

Boiling Point：

359.4ºC at 760mmHg

Refractive Index：

1.546

Safety Information

Hazard category：

IRRITANT

hazard class code：

R20/21/22

safety instructions：

S36/37

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302+H312+H332

GHS Classification：

|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:176.17
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.058577502
Monoisotopic Mass:176.058577502
Topological Polar Surface Area:70
Heavy Atom Count:13
Complexity:393
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Latest News on 5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE

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Guide of 5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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5-ACETYL-6-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBONITRILE

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