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| Name |
3-Aminomethylmorpholine-4-carboxylic acid tert-butyl ester |
EINECS | N/A |
| CAS No. | 475106-18-4 | Density | 1.078g/cm3 |
| PSA | 64.79000 | LogP | 1.21920 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H20N2O3 | Boiling Point | 310.7ºC at 760 mmHg |
| Molecular Weight | 216.28 | Flash Point | 141.7ºC |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N-Boc-3-aminomethylmorpholine; |
3-Aminomethylmorpholine-4-carboxylic acid tert-butyl ester Specification
The 3-Aminomethylmorpholine-4-carboxylic acid tert-butyl ester with cas registry number of 475106-18-4, has IUPAC name of tert-butyl 3-(aminomethyl)morpholine-4-carboxylate. It is also called 3-Aminomethyl-morpholine-4-carboxylic acid tert-butyl ester.
Physical properties about this chemical are: (1)XLogP3-AA: -0.1; (2)H-Bond Donor: 1; (3)H-Bond Acceptor: 4; (4)Rotatable Bond Count: 3; (5)Exact Mass: 216.147393; (6)MonoIsotopic Mass: 216.147393; (7)Topological Polar Surface Area: 64.8; (8)Heavy Atom Count: 15; (9)Formal Charge: 0; (10)Complexity: 225; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 0; (13)Undefined Atom StereoCenter Count: 1; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCOCC1CN;
(2)InChI: InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-4-5-14-7-8(12)6-11/h8H,4-7,11H2,1-3H3;
(3)InChIKey: IRSSIQNSBCQILH-UHFFFAOYSA-N
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