4-Dimethylamino-2-phenyl-butanoic acid supplier

Name
4-(dimethylamino)-2-phenylbutanoic acid
EINECS
CAS No. 7468-02-2
Density 1.085 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₇NO₂
Boiling Point 329.1 °C at 760 mmHg
Molecular Weight 207.272
Flash Point 152.8 °C
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Risk Codes
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Hazard Symbols
Synonyms
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4-Dimethylamino-2-phenyl-butanoic acid Specification

The 4-Dimethylamino-2-phenyl-butanoic acid has CAS registry number 7468-02-2. Its molecular formula is C₁₂H₁₇NO₂ and molecular weight is 207.268880. What's more, its IUPAC name is 4-(Dimethylamino)-2-phenylbutanoic acid.

Physical properties about the 4-Dimethylamino-2-phenyl-butanoic acid are: (1)ACD/LogP: 1.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 29.54 Å²; (7)Index of Refraction: 1.537; (8)Molar Refractivity: 59.62 cm³; (9)Molar Volume: 190.9 cm³; (10)Surface Tension: 43.1 dyne/cm; (11)Density: 1.085 g/cm³; (12)Flash Point: 152.8 °C; (13)Enthalpy of Vaporization: 60.33 kJ/mol; (14)Boiling Point: 329.1 °C at 760 mmHg; (15)Vapour Pressure: 7.31E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C(c1ccccc1)CCN(C)C
(2) InChI: InChI=1/C12H17NO2/c1-13(2)9-8-11(12(14)15)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3,(H,14,15)
(3) InChIKey: QXPZGAJQZGMTCZ-UHFFFAOYAE

Product Name

4-(dimethylamino)-2-phenylbutanoic acid

4-Dimethylamino-2-phenyl-butanoic acid Specification

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