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Basic Information
CAS No.: 62029-79-2
Name: 2-amino-N-ethylacetamide
Molecular Structure:
Molecular Structure of 62029-79-2 (2-amino-N-ethylacetamide)
Formula: C4H11N2O
Molecular Weight: 102.136
Synonyms: ZINC04205454;[2-(Ethylamino)-2-oxoethyl]azanium;
Density: 0.980±0.06 g/cm3(Predicted)
Melting Point: 17-19 °C (decomp)
Boiling Point: 268.7 °C at 760 mmHg
Flash Point: 116.3 °C
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Specification

The Ethylcarbamoylmethylazanium, with the CAS registry number 62029-79-2, is also known as ZINC04205454. This chemical's molecular formula is C4H11N2O and molecular weight is 103.14. What's more, its systematic IUPAC name is [2-(Ethylamino)-2-oxoethyl]azanium.

Physical properties of Ethylcarbamoylmethylazanium are: (1)ACD/LogP: -1.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.16; (4)ACD/LogD (pH 7.4): -1.57; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 2.41; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å2; (13)Flash Point: 116.3 °C; (14)Enthalpy of Vaporization: 50.68 kJ/mol; (15)Boiling Point: 268.7 °C at 760 mmHg; (16)Vapour Pressure: 0.00757 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCNC(=O)C[NH3+]
(2)InChI: InChI=1S/C4H10N2O/c1-2-6-4(7)3-5/h2-3,5H2,1H3,(H,6,7)/p+1
(3)InChIKey: QCQZFSUBYDWVBG-UHFFFAOYSA-O