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Basic Information
CAS No.: 2613-89-0
Name: Phenylmalonic acid
Article Data: 35
Molecular Structure:
Molecular Structure of 2613-89-0 (Phenylmalonic acid)
Formula: C9H8O4
Molecular Weight: 180.16
Synonyms: Malonicacid, phenyl- (6CI,7CI,8CI);Propanedioic acid, phenyl- (9CI);2-Phenylmalonicacid;NSC 27164;NSC 41697;Toluene-a,a-dicarboxylic acid;a-Carboxyphenylacetic acid;a-Phenylmalonic acid;
EINECS: 220-044-6
Density: 1.399 g/cm3
Melting Point: 149-152 °C (dec.)(lit.)
Boiling Point: 363 °C at 760 mmHg
Flash Point: 187.5 °C
Solubility: soluble in water
Appearance: white to off-white crystalline powder
Hazard Symbols: HarmfulXn, IrritantXi
Risk Codes: 36/37/38-41-22
Safety: 26-36-24/25
PSA: 74.60000
LogP: 0.93940
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Chemistry

Molecular Structure:

Molecular Formula: C9H8O4
Molecular Weight: 180.1574
IUPAC Name: 2-Phenylpropanedioic acid
Synonyms of Propanedioic acid,2-phenyl- (CAS NO.2613-89-0): 2-Phenylmalonic acid ; EINECS 220-044-6 ; NSC 27164 ; NSC 41697 ; Phenylmalonic acid ; Toluene-alpha,alpha-dicarboxylic acid ; alpha-Carboxyphenylacetic acid ; Malonic acid, phenyl- (8CI) ; Propanedioic acid, phenyl-
CAS NO: 2613-89-0
Classification Code: Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts ; Carboxylic Acid Monomers ; Monomers ; Polymer Science
Melting point: 149-152 °C 
Index of Refraction: 1.591
Molar Refractivity: 43.56 cm3
Molar Volume: 128.7 cm3
Surface Tension: 65.2 dyne/cm
Density: 1.399 g/cm3
Flash Point: 187.5 °C
Enthalpy of Vaporization: 64.26 kJ/mol
Boiling Point: 363 °C at 760 mmHg
Vapour Pressure: 6.63E-06 mmHg at 25°C

Uses

  Propanedioic acid,2-phenyl- (CAS NO.2613-89-0) is used as antibiotic drugs penicillin sodium carboxy benzyl intermediate.

Safety Profile

Hazard Codes of Propanedioic acid,2-phenyl- (CAS NO.2613-89-0): IrritantXi,Xn
Risk Statements: 36/37/38-41-22 
R36/37/38: Irritating to eyes, respiratory system and skin. 
R41: Risk of serious damage to the eyes. 
R22: Harmful if swallowed.
Safety Statements: 26-36-24/25 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36: Wear suitable protective clothing. 
S24/25: Avoid contact with skin and eyes.
WGK Germany: 3