Cas no 16470-03-4 (2,4,7-Pteridinetriamine,6-(3,4-dichlorophenyl)-)
16470-03-4 structure
Product Name:2,4,7-Pteridinetriamine,6-(3,4-dichlorophenyl)-
CAS No:16470-03-4
MF:C12H9Cl2N7
MW:322.152758359909
CID:230464
PubChem ID:315371
Update Time:2025-04-19
2,4,7-Pteridinetriamine,6-(3,4-dichlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,7-Pteridinetriamine,6-(3,4-dichlorophenyl)-
- 6-(3,4-dichlorophenyl)pteridine-2,4,7-triamine
- 6-(3,4-dichloro-phenyl)-pteridine-2,4,7-triamine
- 6-(3,4-Dichlor-phenyl)-2,4,7-triamino-pteridin
- AC1L7RK9
- NSC240509
- 16470-03-4
- NSC-240509
- DTXSID50311219
- NSC 240509
-
- Inchi: 1S/C12H9Cl2N7/c13-5-2-1-4(3-6(5)14)7-9(15)19-11-8(18-7)10(16)20-12(17)21-11/h1-3H,(H6,15,16,17,19,20,21)
- InChI Key: WIMZXSZGSQNCEQ-UHFFFAOYSA-N
- SMILES: ClC1=C(C=CC(=C1)C1C(N)=NC2=C(C(N)=NC(N)=N2)N=1)Cl
Computed Properties
- Exact Mass: 321.02997
- Monoisotopic Mass: 321.03
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 374
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 130?2
Experimental Properties
- Density: 1.673
- Boiling Point: 615.4°C at 760 mmHg
- Flash Point: 326°C
- Refractive Index: 1.816
- PSA: 129.62
- LogP: 3.88380
2,4,7-Pteridinetriamine,6-(3,4-dichlorophenyl)- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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