17,18-Dichloro-7-ethyldodecahydro-10,13-bis(hydroxymethyl)-3-phenylpyrrolo(2,1-c)(1,4,7,10,13)pentaazacyclohexadecine-1,5,8,11,14(2H)-pentone
[CAS# 10089-09-5]

Identification

• Name: 17,18-Dichloro-7-ethyldodecahydro-10,13-bis(hydroxymethyl)-3-phenylpyrrolo(2,1-c)(1,4,7,10,13)pentaazacyclohexadecine-1,5,8,11,14(2H)-pentone
• Synonyms: 17,18-Dichloro-9-Ethyl-3,6-Dimethylol-13-Phenyl-1,4,7,10,14-Pentazabicyclo[14.3.0]Nonadecane-2,5,8,11,15-Pentone; 17,18-Dichloro-7-Ethyldodecahydro-10,13-Bis(Hydroxymethyl)-3-Phenylpyrrolo(2,1-C)(1,4,7,10,13)Pentaazacyclohexadecine-1,5,8,11,14(2H)-Pentone; Pyrrolo(2,1-C)(1,4,7,10,13)Pentaazacyclohexadecine-1,5,8,11,14(2H)-Pentone, 17,18-Dichloro-7-Ethyldodecahydro-10,13-Bis(Hydroxymethyl)-3-Phenyl-
• Molecular Formula: C₂₄H₃₁Cl₂N₅O₇
• Molecular Weight: 572.44
• CAS Registry Number: 10089-09-5
• SMILES: C3=C(C1NC(=O)C2N(C(=O)C(NC(=O)C(NC(=O)C(NC(=O)C1)CC)CO)CO)CC(Cl)C2Cl)C=CC=C3
• InChI: 1S/C24H31Cl2N5O7/c1-2-14-21(35)29-16(10-32)22(36)30-17(11-33)24(38)31-9-13(25)19(26)20(31)23(37)28-15(8-18(34)27-14)12-6-4-3-5-7-12/h3-7,13-17,19-20,32-33H,2,8-11H2,1H3,(H,27,34)(H,28,37)(H,29,35)(H,30,36)
• InChIKey: AIUAVRQIJPKJTG-UHFFFAOYSA-N

Properties

• Density: 1.474g/cm³ (Cal.)
• Boiling point: 1056.901°C at 760 mmHg (Cal.)
• Flash point: 592.992°C (Cal.)