Cas no 95310-88-6 (Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI))
95310-88-6 structure
Product Name:Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI)
CAS No:95310-88-6
MF:C7H12O5
MW:176.167182922363
CID:799345
PubChem ID:7018009
Update Time:2025-04-19
Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI)
- (S)-3-HYDROXYGLUTARATE ETHYL
- ETHYL (S)-3-HYDROXYGLUTARATE
- SCHEMBL10713162
- AKOS006295441
- (3S)-5-ETHOXY-3-HYDROXY-5-OXOPENTANOIC ACID
- 95310-88-6
- 95310-87-5
- (S)-5-ethoxy-3-hydroxy-5-oxopentanoic acid
-
- Inchi： 1S/C7H12O5/c1-2-12-7(11)4-5(8)3-6(9)10/h5,8H,2-4H2,1H3,(H,9,10)/t5-/m0/s1
- InChI Key： OEJAZOGPPRWZKM-YFKPBYRVSA-N
- SMILES： O[C@@H](CC(=O)O)CC(=O)OCC
Computed Properties
- Exact Mass: 176.06800
- Monoisotopic Mass: 176.06847348g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 165
- 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
- XLogP3: -0.7
- Topological Polar Surface Area: 83.8?2
Experimental Properties
- PSA: 83.83000
- LogP: -0.22480
Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI) Customs Data
- HS CODE：2918990090
- Customs Data：
China Customs Code:
2918990090Overview:
2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI) Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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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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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
95310-88-6 (Pentanedioic acid,3-hydroxy-, monoethyl ester, (3R)- (9CI)) Related Products
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