Cas no 175170-89-5 (N,N-didesmethylgrossularine)
N,N-didesmethylgrossularine structure
Product Name:N,N-didesmethylgrossularine
CAS No:175170-89-5
MF:C21H14N6O
MW:366.375463008881
CID:2029280
Update Time:2025-04-21
N,N-didesmethylgrossularine Chemical and Physical Properties
Names and Identifiers
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- N,N-didesmethylgrossularine
- N,N-didesmethylgrossularine-1
- N,N-Didesmethylgrossularine 1
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- Inchi： 1S/C21H14N6O/c22-21-26-16-15-11-6-2-4-8-14(11)24-20(15)25-18(17(16)27-21)19(28)12-9-23-13-7-3-1-5-10(12)13/h1-9,23H,(H,24,25)(H3,22,26,27)
- InChI Key： WNDIVVRKTNRQAS-UHFFFAOYSA-N
- SMILES： NC1NC2C(C(C3C4C(=CC=CC=4)NC=3)=O)=NC3=C(C=2N=1)C1C(=CC=CC=1)N3
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 28
- XLogP3: 2.634
N,N-didesmethylgrossularine Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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