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65104-60-1

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Basic Information
CAS No.: 65104-60-1
Name: Dimorpholinium tetradecyl phosphate
Molecular Structure:
Molecular Structure of 65104-60-1 (Dimorpholinium tetradecyl phosphate)
Formula: C22H49N2O6P
Molecular Weight: 468.608021
Synonyms: Dimorpholin-4-ium tetradecyl phosphate;
EINECS: 265-432-6
Boiling Point: 413.1 °C at 760 mmHg
Flash Point: 203.6 °C
PSA: 133.91000
LogP: 5.97160
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Specification

The CAS registry number of Dimorpholinium tetradecyl phosphate is 65104-60-1. This chemical is also named as Dimorpholin-4-ium tetradecyl phosphate. Its EINECS registry number is 265-432-6. In addition, its molecular formula is C22H49N2O6P and molecular weight is 468.608021. Its systematic is called tetradecyl dihydrogen phosphate - morpholine (1:2).

Physical properties about Dimorpholinium tetradecyl phosphate are: (1)ACD/LogP: 5.32; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.05; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 3.5; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 10.06; (8)ACD/KOC (pH 7.4): 1.14; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 14; (11)Flash Point: 203.6 °C; (12)Enthalpy of Vaporization: 73.04 kJ/mol; (13)Boiling Point: 413.1 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P(O)(O)OCCCCCCCCCCCCCC.O1CCNCC1.O1CCNCC1
(2)InChI: InChI=1/C14H31O4P.2C4H9NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17;2*1-3-6-4-2-5-1/h2-14H2,1H3,(H2,15,16,17);2*5H,1-4H2
(3)InChIKey: DNIQWPSYSBMKAR-UHFFFAOYAG