Cas no 68398-22-1 (calcium dimethylhexanoate)
calcium dimethylhexanoate structure
Product Name:calcium dimethylhexanoate
CAS No:68398-22-1
MF:C16H30CaO4
MW:326.485004901886
CID:970343
PubChem ID:21149517
Update Time:2025-04-19
calcium dimethylhexanoate Chemical and Physical Properties
Names and Identifiers
-
- calcium dimethylhexanoate
- calcium,2,2-dimethylhexanoate
- NS00091180
- SCHEMBL4540510
- Hexanoic acid, dimethyl-, calcium salt (2:1)
- 68398-22-1
- EINECS 269-973-9
- Hexanoic acid, dimethyl-, calcium salt
- RNCQGJUPJDXLAI-UHFFFAOYSA-L
-
- Inchi： 1S/2C8H16O2.Ca/c2*1-4-5-6-8(2,3)7(9)10;/h2*4-6H2,1-3H3,(H,9,10);/q;;+2/p-2
- InChI Key： RNCQGJUPJDXLAI-UHFFFAOYSA-L
- SMILES： [Ca+2].[O-]C(C(C)(C)CCCC)=O.[O-]C(C(C)(C)CCCC)=O
Computed Properties
- Exact Mass: 326.1770003g/mol
- Monoisotopic Mass: 326.1770003g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 111
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 80.3?2
calcium dimethylhexanoate Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Ruili Liu,Mengping Gao,Jing Zhang,Zhilian Li,Jinyang Chen,Ping Liu,Dongqing Wu RSC Adv., 2015,5, 24205-24209
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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