1,3,2-Diazaphosphorin-2(1H)-amine,N-(2-chloroethyl)-1,3-bis[(4-chlorophenyl)methyl]tetrahydro-, 2-oxide supplier

Name
1,3-bis(4-chlorobenzyl)-N-(2-chloroethyl)-1,3,2-diazaphosphinan-2-amine 2-oxide
EINECS
CAS No. 14745-89-2
Density 1.37 g/cm³
Solubility
Melting Point
Formula C₁₉H₂₃Cl₃N₃OP
Boiling Point 561.9 °C at 760 mmHg
Molecular Weight 446.744
Flash Point 293.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,3,2-Diazaphosphorine,1,3-bis(p-chlorobenzyl)-2-[(2-chloroethyl)amino]hexahydro-, 2-oxide (8CI);NSC88658;1,3-Bis(4-chlorobenzyl)-N-(2-chloroethyl)-1,3,2-diazaphosphinan-2-amine 2-oxide;
PSA
LogP

1,3,2-Diazaphosphorin-2(1H)-amine,N-(2-chloroethyl)-1,3-bis[(4-chlorophenyl)methyl]tetrahydro-, 2-oxide Specification

The 1,3,2-Diazaphosphorin-2(1H)-amine,N-(2-chloroethyl)-1,3-bis[(4-chlorophenyl)methyl]tetrahydro-, 2-oxide, with the CAS registry number 14745-89-2, is also known as 1,3,2-Diazaphosphorine,1,3-bis(p-chlorobenzyl)-2-[(2-chloroethyl)amino]hexahydro-, 2-oxide (8CI). This chemical's molecular formula is C₁₉H₂₃Cl₃N₃OP and molecular weight is 446.74. What's more, its systematic name is 1,3-bis(4-chlorobenzyl)-N-(2-chloroethyl)-1,3,2-diazaphosphinan-2-amine 2-oxide.

Physical properties of 1,3,2-Diazaphosphorin-2(1H)-amine,N-(2-chloroethyl)-1,3-bis[(4-chlorophenyl)methyl]tetrahydro-, 2-oxide are: (1)ACD/LogP: 5.46; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 36.6 Å²; (7)Index of Refraction: 1.621; (8)Molar Refractivity: 114.48 cm³; (9)Molar Volume: 325.1 cm³; (10)Polarizability: 45.38×10^-24cm³; (11)Surface Tension: 57.1 dyne/cm; (12)Density: 1.37 g/cm³; (13)Flash Point: 293.6 °C; (14)Enthalpy of Vaporization: 84.49 kJ/mol; (15)Boiling Point: 561.9 °C at 760 mmHg; (16)Vapour Pressure: 1.18E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P2(NCCCl)N(CCCN2Cc1ccc(Cl)cc1)Cc3ccc(Cl)cc3
(2)InChI: InChI=1S/C19H23Cl3N3OP/c20-10-11-23-27(26)24(14-16-2-6-18(21)7-3-16)12-1-13-25(27)15-17-4-8-19(22)9-5-17/h2-9H,1,10-15H2,(H,23,26)
(3)InChIKey: YRUCUZWMQGIUIX-UHFFFAOYSA-N

Product Name

1,3-bis(4-chlorobenzyl)-N-(2-chloroethyl)-1,3,2-diazaphosphinan-2-amine 2-oxide

1,3,2-Diazaphosphorin-2(1H)-amine,N-(2-chloroethyl)-1,3-bis[(4-chlorophenyl)methyl]tetrahydro-, 2-oxide Specification

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