Cas no 5785-16-0 (2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]-)
![2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]- structure](https://ossimg.kuujia.com/scimg/6000/5785-16-0x500.png)
5785-16-0 structure
Product Name:2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]-
CAS No:5785-16-0
MF:C11H11N3O
MW:201.224541902542
CID:381401
PubChem ID:308512
Update Time:2025-04-19
2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]-
- 4-(benzylamino)-2-pyrimidinol
- 4-(benzylamino)-pyrimidin-2-ol
- 4-Benzylamino-1H-pyrimidin-2-on
- 4-benzylamino-1H-pyrimidin-2-one
- 4-Benzylaminocytosine
- 4-Benzylamino-pyrimidin-2(1H)-one
- 4-N-Benzylcytosine
- 4-N-phenylmethylcytosine
- AC1L7D1B
- CHEMBL2063052
- N4 -benzyl-cytosine
- N4-benzylcytosine
- NSC210324
- SureCN248683
- 4-(Benzylamino)-2(1H)-pyrimidinone #
- LHOUXFCFCBCKPY-UHFFFAOYSA-N
- NSC-210324
- NSC 210324
- AKOS015917094
- 6-(benzylamino)-1H-pyrimidin-2-one
- 5785-16-0
- SCHEMBL248683
- DTXSID60308877
- BDBM50389495
-
- Inchi： 1S/C11H11N3O/c15-11-12-7-6-10(14-11)13-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,12,13,14,15)
- InChI Key： LHOUXFCFCBCKPY-UHFFFAOYSA-N
- SMILES： O=C1N=CC=C(N1)NCC1C=CC=CC=1
Computed Properties
- Exact Mass: 201.09033
- Monoisotopic Mass: 201.090211983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 290
- 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: 1
- Topological Polar Surface Area: 53.5?2
Experimental Properties
- PSA: 53.49
2(1H)-Pyrimidinone,6-[(phenylmethyl)amino]- Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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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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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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