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CAS No.: | 833474-06-9 |
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Name: | 3-FORMYL-MORPHOLINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C10H17NO4 |
Molecular Weight: | 215.249 |
Synonyms: | tert-Butyl 3-(formyl)morpholine-4-carboxylate;4-Morpholinecarboxylicacid, 3-formyl-,1,1-dimethylethyl ester; |
Density: | 1.181 g/cm3 |
Boiling Point: | 308.977 °C at 760 mmHg |
Flash Point: | 140.665 °C |
PSA: | 55.84000 |
LogP: | 0.75910 |
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The CAS registry number of 4-Morpholinecarboxylicacid, 3-formyl-, 1,1-dimethylethyl ester is 833474-06-9. The IUPAC name is tert-butyl 3-formylmorpholine-4-carboxylate. In addition, the molecular formula is C10H17NO4 and the molecular weight is 215.25. What's more, it should be stored in a cool and dry place.
Physical properties about 4-Morpholinecarboxylicacid, 3-formyl-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 0.52; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 37; (5)ACD/KOC (pH 7.4): 37; (6)#H bond acceptors: 5; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 55.84 Å2; (9)Index of Refraction: 1.516; (10)Molar Refractivity: 55.042 cm3; (11)Molar Volume: 182.317 cm3; (12)Polarizability: 21.821 ×10-24cm3; (13)Surface Tension: 46.577 dyne/cm; (14)Density: 1.181 g/cm3; (15)Flash Point: 140.665 °C; (16)Enthalpy of Vaporization: 54.97 kJ/mol; (17)Boiling Point: 308.977 °C at 760 mmHg; (18)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCOCC1C=O
(2)InChI: InChI=1/C10H17NO4/c1-10(2,3)15-9(13)11-4-5-14-7-8(11)6-12/h6,8H,4-5,7H2,1-3H3
(3)InChIKey: MOLHQYMJBRBXAN-UHFFFAOYAD