Cas no 64446-63-5 (1,2,3-HEXANETRIOL, (R*,R*)-)
1,2,3-HEXANETRIOL, (R*,R*)- structure
Product Name:1,2,3-HEXANETRIOL, (R*,R*)-
CAS No:64446-63-5
MF:C6H14O3
MW:134.173562526703
CID:3176277
PubChem ID:6950290
Update Time:2025-04-21
1,2,3-HEXANETRIOL, (R*,R*)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-HEXANETRIOL, (R*,R*)-
- 910658-42-3
- UNII-196X88B92F
- 1,2,3-Hexanetriol, (2R,3R)-(+)-
- 64446-63-5
- 1,2,3-Hexanetriol, (2R,3R)-rel-
- 1,2,3-Hexanetriol, (R,R)-(+/-)-
- SCHEMBL16118964
- 4ATK82695L
- 196X88B92F
- UNII-4ATK82695L
- 1,2,3-Hexanetriol, (2R,3R)-
-
- Inchi： 1S/C6H14O3/c1-2-3-5(8)6(9)4-7/h5-9H,2-4H2,1H3/t5-,6-/m1/s1
- InChI Key： XYXCXCJKZRDVPU-PHDIDXHHSA-N
- SMILES： O[C@@H]([C@@H](CO)O)CCC
Computed Properties
- Exact Mass: 134.094294304g/mol
- Monoisotopic Mass: 134.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 65.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.4
- Topological Polar Surface Area: 60.7?2
1,2,3-HEXANETRIOL, (R*,R*)- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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