3-Propyltoluene - ≥99%(GC) , CAS No.1074-43-7

CAS: 1074-43-7 Cat. No.: P160391 分子式: C₁₀H₁₄ 分子量: 134.22 Beilstein Registry Number: 5(4)1056 EC番号: 214-040-3 PubChem CID: 14092

GRADE & PURITY ≥99%(GC)

Synonyms

1-Methyl-3-n-propylbenzene | EINECS 214-040-3 | 1-METHYL-3-PROPYLBENZENE | 1-methyl-3-propyl-benzene | AKOS016846127 | 1-Methyl-3-n-propyl benzene | I0ZJ4I1KOV | FT-0723288 | 3-n-Propyltoluene | D92006 | m-Propyltoluene | Toluene, m-propyl- | LS-13805 | M

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifications

同義語

1-Methyl-3-n-propylbenzene | EINECS 214-040-3 | 1-METHYL-3-PROPYLBENZENE | 1-methyl-3-propyl-benzene | AKOS016846127 | 1-Methyl-3-n-propyl benzene | I0ZJ4I1KOV | FT-0723288 | 3-n-Propyltoluene | D92006 | m-Propyltoluene | Toluene, m-propyl- | LS-13805 | M

仕様と純度

≥99%(GC)

保管条件

Store at 2-8°C

入荷

Wet ice,FedEx DG Service

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥99%(GC)

名前と識別子

パブケム・シド

504752523

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504752523

カノニカル・スマイル

CCCC1=CC=CC(=C1)C

IUPAC Name

1-methyl-3-propylbenzene

InChIKey

QUEBYVKXYIKVSO-UHFFFAOYSA-N

INCHI

1S/C10H14/c1-3-5-10-7-4-6-9(2)8-10/h4,6-8H,3,5H2,1-2H3

異性体SMILES

CCCC1=CC=CC(=C1)C

PubChem CID

14092

UN番号

3295

包装グループ

III

分子量

134.22

Beilstein

5(4)1056

Reaxy-Rn

1923702

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Phenylpropanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Phenylpropanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpropanes
• Alternative Parents: Toluenes Aromatic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylpropane - Toluene - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

化学的性質と物理的性質

• 屈折率: 1.4910-1.4940
• 引火点（°C）: 56 °C
• 沸点（°C）: 181°C
• 分子量: 134.220 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 134.11 Da
• Monoisotopic Mass: 134.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 86.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

よくある質問

What is the purity of this product, and how is it determined?

This product is supplied at ≥99% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1074-43-7, the molecular formula is C10H14, and the molecular weight is 134.22 g/mol. InChIKey QUEBYVKXYIKVSO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.