Cas no 98405-54-0 (5-Pyrimidinecarboxamide,N,N-dimethyl-)
98405-54-0 structure
Product Name:5-Pyrimidinecarboxamide,N,N-dimethyl-
CAS No:98405-54-0
MF:C7H9N3O
MW:151.165860891342
CID:801761
PubChem ID:21791173
Update Time:2025-04-19
5-Pyrimidinecarboxamide,N,N-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 5-Pyrimidinecarboxamide,N,N-dimethyl-
- 5-Pyrimidinecarboxamide,N,N-dimethyl-(9CI)
- N,N-dimethylpyrimidine-5-carboxamide
- AKOS006304736
- 98405-54-0
- WHXFPACQVZIETN-UHFFFAOYSA-N
-
- Inchi： 1S/C7H9N3O/c1-10(2)7(11)6-3-8-5-9-4-6/h3-5H,1-2H3
- InChI Key： WHXFPACQVZIETN-UHFFFAOYSA-N
- SMILES： O=C(C1=CN=CN=C1)N(C)C
Computed Properties
- Exact Mass: 151.074561919g/mol
- Monoisotopic Mass: 151.074561919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 141
- 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: -0.3
- Topological Polar Surface Area: 46.1?2
5-Pyrimidinecarboxamide,N,N-dimethyl- Related Literature
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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