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3-Methoxybenzoic acid

3-Methoxybenzoic acid structure

CAS No:
586-38-9
Formula:
C8H8O3
Chemical Name:
3-Methoxybenzoic acid
Synonyms:
Benzoic acid,3-methoxy-;m-Anisic acid;3-Methoxybenzoic acid;m-Methoxybenzoic acid;3-Anisic acid;NSC 27014;NSC 9264
Categories:
Flavors and Fragrances > Synthetic Fragrances

Description

3-Methoxybenzoic acid can be used in the synthesis of 3-methoxybenzoates of europium (III) and gadolinium (III).

Solid|white crystals, practically odourless

3-methoxybenzoic acid is a methoxybenzoic acid that is benzoic acid substituted by a methoxy group at position 3. It has a role as a flavouring agent and a human urinary metabolite. It derives from a 3-hydroxybenzoic acid. It is a conjugate acid of a 3-methoxybenzoate.

3-Methoxybenzoic acid Basic Attributes

Molecular Weight：

152.15

Exact Mass：

152.15

BRN：

508838

EC Number：

209-574-9

UNII：

E2I36FH6QZ

NSC Number：

27014|9264

DSSTox ID：

DTXSID2060410

HScode：

29189090

Characteristics

PSA：

46.5

XLogP3：

Appearance：

Off-white to slightly yellow-beige Powder

Density：

1.2±0.1 g/cm3

Melting Point：

107 °C

Boiling Point：

170 °C

Flash Point：

170-172°C/10mm

Refractive Index：

1.546

Water Solubility：

soluble in 95% ethanol (50 mg/ml), water (2 mg/ml at 25°C) and methanol.

Storage Conditions：

Store below +30°C.

Toxicity：

Abdominal cavity-mouse LDL0: 250 mg/kg

Flammability characteristics：

Flammable; burning produces irritating fumes

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38-22-20/21/22

safety instructions：

26-36-24/25

RTECS Number：

BZ4375000

Marks：

Xi,Xn

Storage features：

Treasury is ventilated, low temperature and dry; stored separately from food materials

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory.

Toxicity

Toxicity class：

highly toxic

Drug Information

MeSH Entry Terms：

3-anisic acid

3-Methoxybenzoic acid Use and Manufacturing

Uses

Used as pesticide and pharmaceutical intermediate

Manufacturing Info：

Benzoic acid, 3-methoxy-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:152.15
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:152.047344113
Monoisotopic Mass:152.047344113
Topological Polar Surface Area:46.5
Heavy Atom Count:11
Complexity:144
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Carbon dioxide

1-Butanol

Dimethyl sulfate

Recommended Suppliers of 3-Methoxybenzoic acid

Greenbo Biochem Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED Intermediates

3-Methoxybenzoic acid 99% high purity certified Professional producer Greenbo

CAS No.: 586-38-9

Grade: Food Grade

Content: 99%

Inquiry
Hangzhou KieRay Chem Co.,LTD Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of fine chemicals,pharmaceutical materials

3-Methoxybenzoic acid

CAS No.: 586-38-9

Grade: industrial Grade

Content: 98%

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Guide of 3-Methoxybenzoic acid

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
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