Cas no 58342-65-7 ((1S,3R,4R)-p-Menthane-1,3-diol)
58342-65-7 structure
Product Name:(1S,3R,4R)-p-Menthane-1,3-diol
CAS No:58342-65-7
MF:C10H20O2
MW:172.264603614807
CID:2017845
PubChem ID:10773537
Update Time:2025-04-21
(1S,3R,4R)-p-Menthane-1,3-diol Chemical and Physical Properties
Names and Identifiers
-
- (1S,3R,4R)-p-Menthane-1,3-diol
- 58342-65-7
- CHEMBL2272667
- (1S,3R,4S)-1-Methyl-4-(1-methylethyl)-1,3-cyclohexanediol
- (-)-(1S,3R,4S)-1-HYDROXYMENTHOL
- (1S,3R,4S)-1-methyl-4-propan-2-ylcyclohexane-1,3-diol
- DTXSID401196262
-
- Inchi： 1S/C10H20O2/c1-7(2)8-4-5-10(3,12)6-9(8)11/h7-9,11-12H,4-6H2,1-3H3/t8-,9+,10-/m0/s1
- InChI Key： IIZCEIWXLSJQFP-AEJSXWLSSA-N
- SMILES： O[C@@]1(C)CC[C@@H](C(C)C)[C@@H](C1)O
Computed Properties
- Exact Mass: 172.146329876g/mol
- Monoisotopic Mass: 172.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 156
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 40.5?2
(1S,3R,4R)-p-Menthane-1,3-diol Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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