CAS No.4410-31-5,DL-MANDELAMIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	4410-31-5
Name:	DL-MANDELAMIDE
Article Data:	60

Formula:	C₈H₉NO₂
Molecular Weight:	151.165
Synonyms:	α-Hydroxybenzylcarboxamide;α-Hydroxybenzeneacetamide;DL-Mandelicacid amide;NSC 16603;Racemic mandelamide;2-Phenylglycolamide;Amygdalinamide;Mandelamide(6CI,7CI,8CI);
Density:	1.246 g/cm³
Melting Point:	133-137 °C (lit.)
Boiling Point:	345.5 °C at 760 mmHg
Flash Point:	162.7 °C
Solubility:	Soluble in water
Appearance:	white Crystalline powder
Hazard Symbols:	Xn
Risk Codes:	22-36/37/38
Safety:	26-36
PSA:	63.32000
LogP:	0.90560

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Specification

The Benzeneacetamide, α-hydroxy-, with the CAS registry number of 4410-31-5, is also known as DL-Mandelicacid amide. It belongs to the product category of Benzene Series. This chemical's molecular formula is C₈H₉NO₂ and molecular weight is 151.16. What's more, its IUPAC name is 2-Hydroxy-2-phenylacetamide. Besides, it can be used to produre Cefonicid.

Physical properties about Benzeneacetamide, α-hydroxy- are: (1)ACD/LogP: -0.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.17; (4)ACD/LogD (pH 7.4): -0.17; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 19.29; (8)ACD/KOC (pH 7.4): 19.28; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.589; (14)Molar Refractivity: 40.9 cm³; (15)Molar Volume: 121.3 cm³; (16)Surface Tension: 57 dyne/cm; (17)Density: 1.246 g/cm³; (18)Flash Point: 162.7 °C; (19)Enthalpy of Vaporization: 62.22 kJ/mol; (20)Boiling Point: 345.5 °C at 760 mmHg; (21)Vapour Pressure: 2.33E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical is harmful if swallowed. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)C(O)c1ccccc1
(2) InChI: InChI=1/C8H9NO2/c9-8(11)7(10)6-4-2-1-3-5-6/h1-5,7,10H,(H2,9,11)
(3) InChIKey: MAGPZHKLEZXLNU-UHFFFAOYAR