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4′-Methylpropiophenone

4′-Methylpropiophenone structure

CAS No:
5337-93-9
Formula:
C10H12O
Chemical Name:
4′-Methylpropiophenone
Synonyms:
1-Propanone,1-(4-methylphenyl)-;Propiophenone,4′-methyl-;1-(4-Methylphenyl)-1-propanone;4′-Methylpropiophenone;p-Methylpropiophenone;Ethyl p-tolyl ketone;Ethyl 4-methylphenyl ketone;1-(4-Tolyl)-1-propanone;NSC 852;1-p-Tolylpropan-1-one
Categories:
Pharmaceutical Intermediates > Analgesics

Description

clear light yellow liquid

4-methylpropiophenone is an aromatic ketone that is propiophenone bearing a methyl group at C-4. It derives from a propiophenone.

4′-Methylpropiophenone Basic Attributes

Molecular Weight：

148.2

Exact Mass：

148.20

BRN：

2042137

EC Number：

226-267-5

UNII：

8490C17WAB

NSC Number：

852

DSSTox ID：

DTXSID00201535

HScode：

2914399090

Characteristics

PSA：

17.1

XLogP3：

2.6

Appearance：

Light yellow liquid.

Density：

0.9883 g/cm³ @ Temp: 21.7 °C

Melting Point：

7.2 °C

Boiling Point：

236 °C

Flash Point：

229 °F

Refractive Index：

1.507

Water Solubility：

soluble in chloroform and hexane.

Storage Conditions：

Keep away from sources of ignition. Store in a cool, dry place. Store in a tightly closed container.

Vapor Pressure：

0.09 mmHg

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

Precautionary statement(s)：

P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 4 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4′-Methylpropiophenone Use and Manufacturing

Intermediate of Naomaining.

Computed Properties

Molecular Weight:148.20
XLogP3:2.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:148.088815002
Monoisotopic Mass:148.088815002
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:132
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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