-
Name
Methyl (R)-3-acetamido-3-(4-chlorophenyl)propanoate
- EINECS
- CAS No. 810670-03-2
- Article Data13
- CAS DataBase
- Density 1.215g/cm3
- Solubility
- Melting Point
- Formula C12H14 Cl N O3
- Boiling Point 435.6oC at 760 mmHg
- Molecular Weight 255.701
- Flash Point 217.3oC
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms (R)-methyl-3-acetamido-3-(4-chlorophenyl)propanoate;METHYL (R)-3-ACETAMIDO-3-(4-CHLOROPHENYL)PROPANOATE
- PSA 55.40000
- LogP 2.47120
Methyl (R)-3-acetamido-3-(4-chlorophenyl)propanoate Chemical Properties
Molecular Structure of Methyl (R)-3-acetamido-3-(4-chlorophenyl)propanoate (CAS No.810670-03-2):
Molecular Formula: C12H14ClNO3
Molecular Weight: 255.6975
CAS No: 810670-03-2
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 5
Polar Surface Area: 46.61 Å2
Index of Refraction: 1.526
Molar Refractivity: 64.63 cm3
Molar Volume: 210.3 cm3
Surface Tension: 41.9 dyne/cm
Density: 1.215 g/cm3
Flash Point: 217.3 °C
Enthalpy of Vaporization: 69.19 kJ/mol
Boiling Point: 435.6 °C at 760 mmHg
Vapour Pressure: 8.63E-08 mmHg at 25°C
Systematic Name: Methyl (3R)-3-(acetylamino)-3-(4-chlorophenyl)propanoate
InChI: InChI=1/C12H14ClNO3/c1-8(15)14-11(7-12(16)17-2)9-3-5-10(13)6-4-9/h3-6,11H,7H2,1-2H3,(H,14,15)/t11-/m1/s1
InChIKey: NRUURHSPHDCNCD-LLVKDONJBP
Std. InChI: InChI=1S/C12H14ClNO3/c1-8(15)14-11(7-12(16)17-2)9-3-5-10(13)6-4-9/h3-6,11H,7H2,1-2H3,(H,14,15)/t11-/m1/s1
Std. InChIKey: NRUURHSPHDCNCD-LLVKDONJSA-N
Methyl (R)-3-acetamido-3-(4-chlorophenyl)propanoate Specification
Methyl (R)-3-acetamido-3-(4-chlorophenyl)propanoate (CAS No.810670-03-2), its synonyms are Benzenepropanoic acid, beta-(acetylamino)-4-chloro-, methyl ester, (betaR)- ; Methyl (3R)-3-acetamido-3-(4-chlorophenyl)propanoate .
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