4-(Hydroxymethyl)phenylacetic acid supplier

Name
4-(HYDROXYMETHYL)PHENYLACETIC ACID
EINECS
CAS No. 73401-74-8
Article Data6
CAS DataBase
Density 1.271 g/cm³
Solubility
Melting Point 131-134 °C(lit.)
Formula C₉H₁₀O₃
Boiling Point 357.841 °C at 760 mmHg
Molecular Weight 166.177
Flash Point 184.406 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(Hydroxymethyl)phenylaceticacid;PAM LINKER;
PSA 57.53000
LogP 0.80600

4-(Hydroxymethyl)phenylacetic acid Specification

The Benzeneacetic acid,4-(hydroxymethyl)-, with the CAS registry number 73401-74-8, is also known as 4-(Hydroxymethyl)phenylacetic acid. It belongs to the product categories of Aromatic Phenylacetic Acids and Derivatives; C₉; Carbonyl Compounds; Carboxylic Acids. This chemical's molecular formula is C₉H₁₀O₃and formula weight is 166.17. What's more, its IUPAC name is 2-[4-(hydroxymethyl)phenyl]acetic acid.

Physical properties of Benzeneacetic acid,4-(hydroxymethyl)- are: (1)ACD/LogP: 0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1.81; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 57.53 Å²; (11)Index of Refraction: 1.585; (12)Molar Refractivity: 43.818 cm³; (13)Molar Volume: 130.693 cm³; (14)Surface Tension: 57.065 dyne/cm; (15)Density: 1.271 g/cm³; (16)Flash Point: 184.406 °C; (17)Enthalpy of Vaporization: 63.654 kJ/mol; (18)Boiling Point: 357.841 °C at 760 mmHg.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Besides you should wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1CC(=O)O)CO
(2)InChI: InChI=1S/C9H10O3/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4,10H,5-6H2,(H,11,12)
(3)InChIKey: FWZBPBKAANKOJQ-UHFFFAOYSA-N

Product Name

4-(HYDROXYMETHYL)PHENYLACETIC ACID

4-(Hydroxymethyl)phenylacetic acid Specification

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