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(3-Amino-1-methylpropyl)carbamic acid benzyl ester

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Name

(3-Amino-1-methylpropyl)carbamic acid benzyl ester

EINECS N/A
CAS No. 885277-95-2 Density 1.086 g/cm3
PSA 64.35000 LogP 2.74130
Solubility N/A Melting Point N/A
Formula C12H18N2O2 Boiling Point 373.8 °C at 760 mmHg
Molecular Weight 222.287 Flash Point 179.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 885277-95-2 (3-CBZ-AMINO-BUTYLAMINE) Hazard Symbols N/A
Synonyms

(3-Amino-1-methylpropyl)carbamic acid benzyl ester;

 

(3-Amino-1-methylpropyl)carbamic acid benzyl ester Specification

The (3-Amino-1-methylpropyl)carbamic acid benzyl ester, its cas register number is 885277-95-2. It also can be called as Carbamic acid,(3-amino-1-methylpropyl)-, phenylmethyl ester (9CI) and the Systematic name about this chemical is benzyl N-(3-amino-1-methyl-propyl)carbamate.

Physical properties about (3-Amino-1-methylpropyl)carbamic acid benzyl ester are: (1)#H bond acceptors: 4; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 7; (4)Polar Surface Area: 64.35Å2; (5)Index of Refraction: 1.529; (6)Molar Refractivity: 63.19 cm3; (7)Molar Volume: 204.6 cm3; (8)Polarizability: 25.05x10-24cm3; (9)Surface Tension: 42.3 dyne/cm; (10)Enthalpy of Vaporization: 62.11 kJ/mol; (11)Vapour Pressure: 8.76E-06 mmHg at 25°C

You can still convert the following datas into molecular structure:
(1)SMILES: CC(CCN)NC(=O)OCc1ccccc1
(2)InChI: InChI=1/C12H18N2O2/c1-10(7-8-13)14-12(15)16-9-11-5-3-2-4-6-11/h2-6,10H,7-9,13H2,1H3,(H,14,15)
(3)InChIKey: WOKDIYCOYIKOQP-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C12H18N2O2/c1-10(7-8-13)14-12(15)16-9-11-5-3-2-4-6-11/h2-6,10H,7-9,13H2,1H3,(H,14,15)
(5)Std. InChIKey: WOKDIYCOYIKOQP-UHFFFAOYSA-N

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