4-Aminomethylphenylaceticacid supplier

Name
4-AMINOMETHYLPHENYLACETIC ACID
EINECS
CAS No. 1200-05-1
Article Data11
CAS DataBase
Density 1.206 g/cm³
Solubility
Melting Point
Formula C₉H₁₁NO₂
Boiling Point 336.7 °C at 760 mmHg
Molecular Weight 165.192
Flash Point 157.4 °C
Transport Information
Appearance
Safety
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xn
Synonyms Aceticacid, (a-amino-p-tolyl)- (6CI,7CI,8CI);4-(Aminomethyl)benzeneacetic acid;4-(Aminomethyl)phenylacetic acid;p-(Aminomethyl)phenylaceticacid;a-Amino-p-tolylacetic acid;
PSA 63.32000
LogP 1.47270

4-Aminomethylphenylaceticacid Specification

The Benzeneacetic acid,4-(aminomethyl)- is an organic compound with the formula C₉H₁₁NO₂. The IUPAC name of this chemical is 2-[4-(aminomethyl)phenyl]acetic acid. With the CAS registry number 1200-05-1, it is also named as 4-Aminomethylphenylacetic acid. The product's category is Pharmacetical.

Physical properties about Benzeneacetic acid,4-(aminomethyl)- are: (1)ACD/LogP: 0.38; (2)ACD/LogD (pH 5.5): -2.14; (3)ACD/LogD (pH 7.4): -2.13; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 29.54 Å²; (12)Index of Refraction: 1.584; (13)Molar Refractivity: 45.81 cm³; (14)Molar Volume: 136.8 cm³; (15)Polarizability: 18.16×10^-24cm³; (16)Surface Tension: 54.2 dyne/cm; (17)Density: 1.206 g/cm³; (18)Flash Point: 157.4 °C; (19)Enthalpy of Vaporization: 61.21 kJ/mol; (20)Boiling Point: 336.7 °C at 760 mmHg; (21)Vapour Pressure: 4.32E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)Cc1ccc(cc1)CN
(2)InChI: InChI=1/C9H11NO2/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6,10H2,(H,11,12)
(3)InChIKey: HAAUVXXFRQXTTQ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C9H11NO2/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6,10H2,(H,11,12)
(5)Std. InChIKey: HAAUVXXFRQXTTQ-UHFFFAOYSA-N

Product Name

4-AMINOMETHYLPHENYLACETIC ACID

4-Aminomethylphenylaceticacid Specification

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