Cas no 86507-74-6 (Propanedioic acid, dimethyl-, mono(phenylmethyl) ester)
86507-74-6 structure
Product Name:Propanedioic acid, dimethyl-, mono(phenylmethyl) ester
CAS No:86507-74-6
MF:C12H14O4
MW:222.237164020538
CID:661485
PubChem ID:11229777
Update Time:2025-04-19
Propanedioic acid, dimethyl-, mono(phenylmethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, dimethyl-, mono(phenylmethyl) ester
- 2,2-dimethyl-3-oxo-3-phenylmethoxypropanoate
- 3-(Benzyloxy)-2,2-dimethyl-3-oxopropanoic acid
- 2,2-dimethyl-3-oxo-3-phenylmethoxypropanoic acid
- SCHEMBL991532
- 86507-74-6
- A1-01475
- 2,2-Dimethyl-malonic acid monobenzyl ester
-
- Inchi： 1S/C12H14O4/c1-12(2,10(13)14)11(15)16-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,13,14)
- InChI Key： USPNXTCBTKAUGB-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C(C(C(=O)O)(C)C)=O
Computed Properties
- Exact Mass: 222.08920892g/mol
- Monoisotopic Mass: 222.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 264
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 63.6?2
Propanedioic acid, dimethyl-, mono(phenylmethyl) ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| A2B Chem LLC | AD93553-500mg |
3-(Benzyloxy)-2,2-dimethyl-3-oxopropanoic acid |
86507-74-6 | 95% | 500mg |
$414.00 | 2024-04-19 | |
| A2B Chem LLC | AD93553-1g |
3-(Benzyloxy)-2,2-dimethyl-3-oxopropanoic acid |
86507-74-6 | 95% | 1g |
$730.00 | 2024-04-19 |
Propanedioic acid, dimethyl-, mono(phenylmethyl) ester Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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2. 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
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
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