Cas no 42963-41-7 (1,3-Dimethyl-6-hydroxylaminouracil)
42963-41-7 structure
Product Name:1,3-Dimethyl-6-hydroxylaminouracil
CAS No:42963-41-7
MF:C6H9N3O3
MW:171.153960943222
CID:2827454
PubChem ID:2785933
Update Time:2025-04-21
1,3-Dimethyl-6-hydroxylaminouracil Chemical and Physical Properties
Names and Identifiers
-
- 1,3-dimethyl-6-hydroxyaminouracil
- DTXCID70334006
- 1,3-dimethyl-6-hydroxyamino-uracil
- AKOS006277595
- IDNXXKWTYARIKB-UHFFFAOYSA-N
- pyrimidine-2,6(1H,3H)-dione, 4-hydroxyamino-1,3-dimethyl-
- 1,3-Dimethyl-6-hydroxylaminouracil
- DTXSID30382982
- 42963-41-7
- SCHEMBL2451501
- 60331-17-1
- Oprea1_072819
- DB-053594
- 6-(Hydroxyamino)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
-
- Inchi： 1S/C6H9N3O3/c1-8-4(7-12)3-5(10)9(2)6(8)11/h3,7,12H,1-2H3
- InChI Key： IDNXXKWTYARIKB-UHFFFAOYSA-N
- SMILES： O=C1N(C)C(C=C(NO)N1C)=O
Computed Properties
- Exact Mass: 171.06439116g/mol
- Monoisotopic Mass: 171.06439116g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 261
- 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: -0.9
- Topological Polar Surface Area: 72.9?2
1,3-Dimethyl-6-hydroxylaminouracil Related Literature
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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