(2E)-3-[4-(Pentyloxy)phenyl]acrylic acid

Basic Information

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CAS Number

62718-63-2

Molecular Formula

C14H18O3

Molecular Weight

234.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

138-145 ºC

Boiling Point

389 ºC

Density

1.089

Flash Point

144 ºC

Refractive Index

1.5557 (estimate)

SMILES

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CCCCCOc1ccc(cc1)/C=C/C(=O)O

InChI

InChI=1S/C14H18O3/c1-2-3-4-11-17-13-8-5-12(6-9-13)7-10-14(15)16/h5-10H,2-4,11H2,1H3,(H,15,16)/b10-7+

InChIKey

WXPBGFBUVHLMSK-JXMROGBWSA-N

LogP

3.3534000000000015

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

240

Synonyms & References

English

3-(4-(Pentyloxy)phenyl)acrylic acid
2-Propenoic acid,3-[4-(pentyloxy)phenyl]-, (2E)-
3-(4-Pentyloxyphenyl)-2-propenoic acid
4-AMYLOXYCINNAMIC ACID
(E)-4-Pentyloxycinnamic acid
3-(4-PENTYLOXY-PHENYL)-ACRYLIC ACID
4-N-PENTYLOXYCINNAMIC ACID
4-Pentoxycinnamic acid
4-pentyloxy-trans-cinnamic acid
4-Pentyloxy-trans-zimtsaeure
P-PENTYLOXYCINNAMIC ACID
RARECHEM BK HW 0210
(E)-3-[4-(Pentyloxy)phenyl]-2-propenoic acid
(2E)-3-[4-(Pentyloxy)phenyl]-2-propenoic acid

MDL Number

MFCD00037797

Customs Code

2918990090

FAQ

What are the physical and chemical properties of (2E)-3-[4-(Pentyloxy)phenyl]acrylic acid (CAS: 62718-63-2)?

(2E)-3-[4-(Pentyloxy)phenyl]acrylic acid is a white crystalline solid with a molecular weight of approximately 262.36 g/mol. It has a low water solubility and is highly reactive, especially under acidic conditions. This compound is sparingly soluble in water but soluble in organic solvents such as ethanol and acetone.

How is (2E)-3-[4-(Pentyloxy)phenyl]acrylic acid (CAS: 62718-63-2) typically synthesized?

(2E)-3-[4-(Pentyloxy)phenyl]acrylic acid can be synthesized via a multi-step process involving the protection of a hydroxyl group, followed by a coupling reaction and subsequent deprotection. This process often uses catalysts and solvents like dichloromethane and triethylamine, achieving high yields and good selectivity.

What industries use (2E)-3-[4-(Pentyloxy)phenyl]acrylic acid (CAS: 62718-63-2)?

(2E)-3-[4-(Pentyloxy)phenyl]acrylic acid is used in various industries, particularly in the pharmaceutical sector for the synthesis of medicinals, in polymer science for the development of novel materials, and in the production of sensors and semiconductors for electronics.

What precautions should be taken when handling (2E)-3-[4-(Pentyloxy)phenyl]acrylic acid (CAS: 62718-63-2)?

Proper handling of (2E)-3-[4-(Pentyloxy)phenyl]acrylic acid requires the use of personal protective equipment such as gloves, goggles, and a lab coat. It should be stored in a fume hood and handled in a well-ventilated area. Spills should be cleaned up using appropriate materials, and all handling should follow the safety data sheet (SDS) guidelines for this compound.