Tetrahydro-3-methyl-N-phenyl-1(2H)-pyrimidineethanamine ethanedioate (1:2)

Base Information

• Chemical Name: Tetrahydro-3-methyl-N-phenyl-1(2H)-pyrimidineethanamine ethanedioate (1:2)
• CAS No.: 77869-59-1
• Molecular Formula: C17H25N3O8
• Molecular Weight: 399.397
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID20999063
• Mol file: 77869-59-1.mol

Synonyms:77869-59-1;Tetrahydro-3-methyl-N-phenyl-1(2H)-pyrimidineethanamine ethanedioate (1:2);N-(2-(3-Methylhexahydropyrimidino)ethyl)aniline oxalate;1(2H)-Pyrimidineethanamine, tetrahydro-3-methyl-N-phenyl-, ethanedioate (1:2);N-[2-(3-Methyltetrahydro-1(2H)-pyrimidinyl)ethyl]aniline ethanedioate (1:2);DTXSID20999063;C13H21N3.2C2H2O4;C13-H21-N3.2C2-H2-O4;LS-135420;Oxalic acid--N-[2-(3-methyl-1,3-diazinan-1-yl)ethyl]aniline (2/1);1(2H)-Pyrimidineethanamine,tetrahydro-3-methyl-N-phenyl-,ethanedioat e(1:2)

Chemical Property of Tetrahydro-3-methyl-N-phenyl-1(2H)-pyrimidineethanamine ethanedioate (1:2)

Chemical Property:

• Vapor Pressure: 3.67E-05mmHg at 25°C
• Boiling Point: 353.1°C at 760 mmHg
• Flash Point: 183.1°C
• PSA: 167.71000
• LogP: -0.04650
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 6
• Exact Mass: 399.16416476
• Heavy Atom Count: 28
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

1(2H)-PYRIMIDINEETHANAMINE, TETRAHYDRO-3-METHYL-N-PHENYL-, ETHANEDIOAT E (1:2) 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCN(C1)CCNC2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O