3- Methoxyacetophenone

3- Methoxyacetophenone
Compound Structure:
Synonyms: 3'-Methoxyacetophenone;586-37-8;3-Methoxyacetophenone;3-Acetylanisole;m-Methoxyacetophenone;1-(3-METHOXYPHENYL)ETHANONE;Ethanone, 1-(3-methoxyphenyl)-;1-(3-Methoxyphenyl)ethan-1-one;NSC 65593
Compound ID: NMPC-296
PubChem ID:

11460
Molecular Formula: C9H10O2
Canonical SMILES: CC(=O)C1=CC(=CC=C1)OC
InChIKey: BAYUSCHCCGXLAY-UHFFFAOYSA-N
About the compound:

GHS Hazard Statements

• H302 (85.71%): Harmful if swallowed [Warning Acute toxicity, oral]

• H312 (14.29%): Harmful in contact with skin [Warning Acute toxicity, dermal]

• H315 (85.71%): Causes skin irritation [Warning Skin corrosion/irritation]

• H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

• H332 (14.29%): Harmful if inhaled [Warning Acute toxicity, inhalation]

• H335 (42.86%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

• H411 (14.29%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

• H412 (28.57%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

150.17 g/mol

XLogP3

1.8

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

2

Exact Mass

150.068079557 g/mol

Monoisotopic Mass

150.068079557 g/mol

Topological Polar Surface Area

26.3Ų

Heavy Atom Count

11

Formal Charge

0

Complexity

143

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Pale yellow liquid; [Alfa Aesar MSDS]

Vapor Pressure

0.08 [mmHg]

Source: PubChem
Source Species: Eremomastax speciosa
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