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3-Methyladipic acid

CAS 3058-01-3C7H12O4MW 160.17

3-Methyladipic acid (CAS 3058-01-3) — formula C7H12O4, molecular weight 160.17; category organic chemicals.

Product Overview

CAS Number3058-01-3
Molecular FormulaC7H12O4
Molecular Weight160.17
LogP0.4
CategoryOrganic Chemicals

Technical Profile

What this product is

3-Methyladipic acid is a carbon-based organic compound with CAS registry number 3058-01-3 and molecular formula C7H12O4 (molecular weight 160.17), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 3058-01-3

Its molecular formula C7H12O4 comprises 7 C, 12 H, 4 O atoms.

Also known as: 3-Methyladipic acid

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3-Methyladipic acid?

The CAS registry number of 3-Methyladipic acid is 3058-01-3.

What is the molecular formula and molecular weight of 3-Methyladipic acid?

Molecular formula C7H12O4, molecular weight 160.17.

What other names is 3-Methyladipic acid known by?

It is also registered under: 3-Methyladipic acid.

Which category does 3-Methyladipic acid belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3-Methyladipic acid (CAS 3058-01-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number3058-01-3
PubChem CID12292
Molecular formulaC7H12O4
IUPAC name3-methylhexanedioic acid

Computed descriptors

Molecular Weight160.17
XLogP30.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass160.07355886
Monoisotopic Mass160.07355886
Topological Polar Surface Area74.6
Heavy Atom Count11

Synonyms and trade names

3-METHYLADIPIC ACID; 3058-01-3; CHEBI:68503; RefChem:390675; (+-)-3-Methyladipic acid; 221-293-3; 3-METHYLHEXANEDIOIC ACID; Hexanedioic acid, 3-methyl-; Hexanedioic acid,3-methyl-; MFCD00002804; 3-methyl-hexanedioic acid; (+)-3-Methyladipic acid; 61898-58-6; 3-methyl-adipic acid; beta-Methyl-adipic acid; (+/-)-3-Methyladipic acid

GHS hazard classification

Reported hazard statementsH315 (100%), H319 (100%), H335 (97.8%)

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

What the public record says

3-Methyladipic acid · CAS 3058-01-3 · C7H12O4.

Physical description and handling notes

Source: PubChem / Wikidata; the batch COA governs where values differ.

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