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Aminophenylacetic acid methyl ester CAS NO.13226-98-7
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Keywords
- (DL)-Methyl phenylglycinate hydrochloride
- (DL)-Methyl phenylglycinate hydrochloride
- DL-2-Phenylglycine methylester hydrochloride
Quick Details
- ProName: Aminophenylacetic acid methyl ester
- CasNo: 13226-98-7
- Application: The Aminophenylacetic acid methyl este...
- ProductionCapacity: Metric Ton/Day
- Purity: 99
- Transportation: The Aminophenylacetic acid methyl este...
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Superiority
The Aminophenylacetic acid methyl ester is an organic compound with the formula C9H11NO2. The systematic name of this chemical is methyl N-phenylglycinate hydrochloride (1:1). With the CAS registry number 13226-98-7, it is also named as L-Phenylglycine methyl ester hydrochloride.
Physical properties about Aminophenylacetic acid methyl ester are: (1)ACD/LogP: 1.26; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 5; (5)ACD/BCF (pH 7.4): 5; (6)ACD/KOC (pH 5.5): 115; (7)ACD/KOC (pH 7.4): 115; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 38.33 Å2; (12)Flash Point: 131.3 °C; (13)Enthalpy of Vaporization: 54.37 kJ/mol; (14)Boiling Point: 293.4 °C at 760 mmHg; (15)Vapour Pressure: 0.0013 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes. When you are using it, wear suitable protective clothing and gloves. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.COC(=O)CNc1ccccc1
(2)InChI: InChI=1/C9H11NO2.ClH/c1-12-9(11)7-10-8-5-3-2-4-6-8;/h2-6,10H,7H2,1H3;1H
(3)InChIKey: AJHZGVMKIXHMNP-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C9H11NO2.ClH/c1-12-9(11)7-10-8-5-3-2-4-6-8;/h2-6,10H,7H2,1H3;1H
(5)Std. InChIKey: AJHZGVMKIXHMNP-UHFFFAOYSA-N
Details
The Aminophenylacetic acid methyl ester is an organic compound with the formula C9H11NO2. The systematic name of this chemical is methyl N-phenylglycinate hydrochloride (1:1). With the CAS registry number 13226-98-7, it is also named as L-Phenylglycine methyl ester hydrochloride.
Physical properties about Aminophenylacetic acid methyl ester are: (1)ACD/LogP: 1.26; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 5; (5)ACD/BCF (pH 7.4): 5; (6)ACD/KOC (pH 5.5): 115; (7)ACD/KOC (pH 7.4): 115; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 38.33 Å2; (12)Flash Point: 131.3 °C; (13)Enthalpy of Vaporization: 54.37 kJ/mol; (14)Boiling Point: 293.4 °C at 760 mmHg; (15)Vapour Pressure: 0.0013 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes. When you are using it, wear suitable protective clothing and gloves. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.COC(=O)CNc1ccccc1
(2)InChI: InChI=1/C9H11NO2.ClH/c1-12-9(11)7-10-8-5-3-2-4-6-8;/h2-6,10H,7H2,1H3;1H
(3)InChIKey: AJHZGVMKIXHMNP-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C9H11NO2.ClH/c1-12-9(11)7-10-8-5-3-2-4-6-8;/h2-6,10H,7H2,1H3;1H
(5)Std. InChIKey: AJHZGVMKIXHMNP-UHFFFAOYSA-N