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13737-36-5

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Basic Information
CAS No.: 13737-36-5
Name: 4-(BROMOMETHYL)PHENYLACETIC ACID
Article Data: 17
Molecular Structure:
Molecular Structure of 13737-36-5 (4-(BROMOMETHYL)PHENYLACETIC ACID)
Formula: C9H9 Br O2
Molecular Weight: 229.073
Synonyms: Aceticacid, (a-bromo-p-tolyl)- (8CI);4-(Bromomethyl)phenylacetic acid; p-(Bromomethyl)phenylacetic acid
Density: 1.565g/cm3
Melting Point: 179-183 °C(lit.)
Boiling Point: 343.1°Cat760mmHg
Flash Point: 161.3°C
Appearance: White to light beige crystalline powder
Hazard Symbols:
Risk Codes: R36/37/38;R42   
Safety:
Hazard Codes Xi
Risk Statements 36/37/38-42
Safety Statements 26-36
RIDADR UN3261
WGK Germany 3
Hazard Note Irritant
HazardClass 8
PackingGroup III
Transport Information: UN 3261
PSA: 37.30000
LogP: 2.20860
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Chemistry


Systematic Name: [4-(Bromomethyl)phenyl]acetic acid
SMILES: BrCc1ccc(cc1)CC(=O)O
InChI: InChI=1/C9H9BrO2/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6H2,(H,11,12) 
InChIKey: WCOCCXZFEJGHTC-UHFFFAOYAF
Empirical Formula: C9H9BrO2
Molecular Weight: 229.0706 
Index of Refraction: 1.599
Molar Refractivity: 50.01 cm3
Molar Volume: 146.3 cm3 
Surface Tension: 52.8 dyne/cm
Density: 1.565 g/cm3
Flash Point: 161.3 °C
Enthalpy of Vaporization: 61.94 kJ/mol
Boiling Point: 343.1 °C at 760 mmHg
Vapour Pressure: 2.76E-05 mmHg at 25 °C
Melting Point: 179-183 °C(lit.)
storage temp. of 4-Bromomethylphenylacetic acid (CAS NO.13737-36-5): Store at RT
Product Categories: Aromatic Phenylacetic Acids and Derivatives; Organic acids; C9; Carbonyl Compounds; Carboxylic Acids

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38-42 
R36/37/38:Irritating to eyes, respiratory system and skin. 
R42:May cause sensitization by inhalation.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
RIDADR: UN3261
WGK Germany: 3
Hazard Note: Irritant
HazardClass: 8
PackingGroup of 4-Bromomethylphenylacetic acid (CAS NO.13737-36-5): III

Specification

  4-Bromomethylphenylacetic acid (CAS NO.13737-36-5), its Synonyms are 4-(Bromomethyl)phenylacetic acid 97% ; 4-Bromomethyl phenylacetic acid ; 2(4-Bromomethyl phenyl)acetic acid ; [4-(Bromomethyl)phenyl]acetic acid ; Benzeneacetic acid, 4-(bromomethyl)- . It is white to light beige crystalline powder.