Cas no 427-78-1 (Gibberic acid)
Gibberic acid structure
Product Name:Gibberic acid
CAS No:427-78-1
MF:C18H20O3
MW:284.349605560303
CID:329076
Update Time:2024-02-29
Gibberic acid Chemical and Physical Properties
Names and Identifiers
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- Gibba-1,3,4a(10a)-triene-10-carboxylicacid, 1,7-dimethyl-8-oxo-, (4ba,7b,9ab,10b)- (9CI)
- gibberic acid
- ASZCVNVMQXNJGH-ZYRRHWMLSA-N
- Gibberic acid
-
- Inchi： 1S/C18H20O3/c1-10-4-3-5-11-12-6-7-17(2)9-18(12,8-13(17)19)15(14(10)11)16(20)21/h3-5,12,15H,6-9H2,1-2H3,(H,20,21)/t12-,15-,17+,18-/m1/s1
- InChI Key： ASZCVNVMQXNJGH-ZYRRHWMLSA-N
- SMILES： O=C1C[C@]23[C@@H](C(=O)O)C4C(C)=CC=CC=4[C@H]2CC[C@@]1(C)C3
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 513
- Topological Polar Surface Area: 54.4
Gibberic acid Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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3. 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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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