Basic information
- CAS
623-61-0- Standard SMILES
CC(C)OC(=O)CO- InChIKey
AZKIQQBSVTWCGY-UHFFFAOYSA-N- Molecular formula
- C5H10O3
- Average molar mass
- 118.13 g/mol
- Monoisotopic mass
- 118.06299418
Names & identifiers
- Preferred name
- Isopropyl hydroxyacetate
- IUPAC
- propan-2-yl 2-hydroxyacetate
- English name
- Isopropyl glycolate
- Molecular formula
- C5H10O3
- Molecular weight
- 118.13
Names & synonyms
Isopropyl hydroxyacetateEINECS 210-804-5DTXSID10211362NSC 14089RefChem:792174DTXCID10133853210-804-5ISOPROPYL GLYCOLATE623-61-0isopropyl 2-hydroxyacetatepropan-2-yl 2-hydroxyacetateMFCD00046747
Show more names
isopropyl glycolat1-carbamoyl-3-propylurea2-hydroxy-3-MethylbutanoateGlycolic acid isopropyl esterpropan-2-yl 2-hydroxyethanoateHydroxyacetic acid isopropyl ester
Acetic acid, hydroxy-, 1-methylethyl esterAcetic acid, 2-hydroxy-, 1-methylethyl esterNSC140892-hydroxyacetic acid isopropyl esterNSC-14089V35MP6VQ38hydroxy-acetic acid isopropyl esterDS-14648
Database identifiers
- CAS
623-61-0- PubChem CID
- 69338
- DTXSID
DTXSID10211362- UNII
- V35MP6VQ38
- EC Number
- 210-804-5
- Nikkaji
- J134.398J
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 77.7
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 159.3 · 159.3±8.0 °C(Predicted)
- Density
- 1.05 · 1.050±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.21 · 13.21±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- Slightly soluble in water.
- FDA UNII
- 35 MP6VQ38 · V35MP6VQ38
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- HS Code
- 2918199890 · 2918199890
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- hs_code
- 2918199890
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesIsopropyl glycolate is used as pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Suppliers54 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Related reactions
14 records
Compound notes
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