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Name |
Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine,N,N-bis[(1S)-1-phenylethyl]- |
EINECS | N/A |
CAS No. | 380230-02-4 | Density | N/A |
PSA | 35.29000 | LogP | 10.48250 |
Solubility | N/A | Melting Point |
88-89 °C |
Formula | C36H30NO2P | Boiling Point | 710.692 °C at 760 mmHg |
Molecular Weight | 539.6 | Flash Point | 383.613 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(S,S,S)-(+)-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)bis(1-phenylethyl)amine;N,N-bis[(1S)-1-phenylethyl]dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine; |
The Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine,N,N-bis[(1S)-1-phenylethyl]-, with the CAS registry number 380230-02-4, is also known as (S,S,S)-(+)-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)bis(1-phenylethyl)amine. This chemical's molecular formula is C36H30NO2P and molecular weight is 539.60. What's more, its systematic name is N,N-bis[(1S)-1-phenylethyl]dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine. Additionally, it should be sealed and stored in cool and dry places.
Physical properties of Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine,N,N-bis[(1S)-1-phenylethyl]- are: (1)ACD/LogP: 8.42; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 35.29 Å2; (7)Flash Point: 383.613 °C; (8)Enthalpy of Vaporization: 103.923 kJ/mol; (9)Boiling Point: 710.692 °C at 760 mmHg; (10)Vapour Pressure: 0 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: O1c6c(c4c(OP1N([C@H](c2ccccc2)C)[C@H](c3ccccc3)C)ccc5c4cccc5)c7c(cc6)cccc7
(2)InChI: InChI=1/C36H30NO2P/c1-25(27-13-5-3-6-14-27)37(26(2)28-15-7-4-8-16-28)40-38-33-23-21-29-17-9-11-19-31(29)35(33)36-32-20-12-10-18-30(32)22-24-34(36)39-40/h3-26H,1-2H3/t25-,26-/m0/s1
(3)InChIKey: LKZPDRCMCSBQFN-UIOOFZCWBG