Cas no 918819-72-4 ((2R,4R)-Heptane-2,4-diol)
(2R,4R)-Heptane-2,4-diol structure
Product Name:(2R,4R)-Heptane-2,4-diol
CAS No:918819-72-4
MF:C7H16O2
MW:132.200742721558
CID:770268
Update Time:2023-08-03
(2R,4R)-Heptane-2,4-diol Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Heptanediol, (2R,4R)-
- (2R,4R)-Heptane-2,4-diol
-
- Inchi： 1S/C7H16O2/c1-3-4-7(9)5-6(2)8/h6-9H,3-5H2,1-2H3/t6-,7-/m1/s1
- InChI Key： XVEOUOTUJBYHNL-RNFRBKRXSA-N
- SMILES： O[C@H](CCC)C[C@@H](C)O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 63.9
- XLogP3: 1
- Topological Polar Surface Area: 40.5
(2R,4R)-Heptane-2,4-diol Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Jason Wan Lab Chip, 2020,20, 4528-4538
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