Cas no 1196146-89-0 (Ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride)
1196146-89-0 structure
Product Name:Ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride
CAS No:1196146-89-0
MF:C8H12ClN3O2
MW:217.652780532837
CID:2616396
Update Time:2023-08-07
Ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride Chemical and Physical Properties
Names and Identifiers
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- ethyl 2-(aminomethyl)pyrimidine-4-carboxylate,hydrochloride
- ETHYL 2-(AMINOMETHYL)PYRIMIDINE-4-CARBOXYLATE HYDROCHLORIDE
- AB63360
- Ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride
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- Inchi： 1S/C8H11N3O2.ClH/c1-2-13-8(12)6-3-4-10-7(5-9)11-6;/h3-4H,2,5,9H2,1H3;1H
- InChI Key： LWSGOTHRZFEITP-UHFFFAOYSA-N
- SMILES： Cl.O(C(C1=CC=NC(CN)=N1)=O)CC
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 175
- Topological Polar Surface Area: 78.1
Ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride Related Literature
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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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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