Cas no 56031-84-6 (Benzeneacetic acid, a-hydroxy-a,4-dimethyl-, (R)- (9CI))
56031-84-6 structure
Product Name:Benzeneacetic acid, a-hydroxy-a,4-dimethyl-, (R)- (9CI)
CAS No:56031-84-6
MF:C10H12O3
MW:180.200483322144
CID:369657
PubChem ID:21123439
Update Time:2025-04-19
Benzeneacetic acid, a-hydroxy-a,4-dimethyl-, (R)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, a-hydroxy-a,4-dimethyl-, (R)- (9CI)
- (R)-2-HYDROXY-2-METHYL(4-METHYLBENZENE)ACETIC ACID
- (R)‐2‐HYDROXY‐2‐P‐TOLYLPROPIONIC ACID
- (R)-(-)-p-methyl atrolactic acid
- (R)-2-hydroxy-2-p-tolyl-propionic acid
- (R)-2-Hydroxy-2-p-tolylpropionic acid
- (R)-2-Hydroxy-2-p-tolyl-propionsaeure
- 2-hydroxy-2-(4-tolyl)propanoic acid
- 2-Hydroxy-2-(p-tolyl)propanoic acid
- Benzeneacetic acid, α-hydroxy-α,4-dimethyl-, (R)-
- 56031-84-6
- (2R)-2-hydroxy-2-(4-methylphenyl)propanoic acid
- (R)-2-hydroxy-2-p-tolylpropanoic acid
- AKOS017343873
-
- Inchi： 1S/C10H12O3/c1-7-3-5-8(6-4-7)10(2,13)9(11)12/h3-6,13H,1-2H3,(H,11,12)/t10-/m1/s1
- InChI Key： LXGWCXBGZLLXHZ-SNVBAGLBSA-N
- SMILES： O[C@](C(=O)O)(C)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 180.07900
- Monoisotopic Mass: 180.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 194
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 57.5A^2
- XLogP3: 1.4
Experimental Properties
- Density: 1.217
- Boiling Point: 342.7°Cat760mmHg
- Flash Point: 175.2°C
- Refractive Index: 1.56
- PSA: 57.53000
- LogP: 1.28710
Benzeneacetic acid, a-hydroxy-a,4-dimethyl-, (R)- (9CI) Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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4. 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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