
CAS Number3581-70-2
SynonymsO-neopentylbenzoate; Benzoesaeure-neopentylester; Neopentyl benzoate; 1-Propanol,2-dimethyl-,benzoate; benzoic acid neopentylester
Molecular Formula(CH3)3CCH2OH
Molecular Weight88.15
Purity99%
Density0.994g/cm3
Boiling Point113-114 °C (lit.)
Melting Point52-56 °C (lit.)
Appearancecrystals
EINECS200-907-3
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3581-70-2 |
| Catalog No. | 2A-9063156 |
| Chinese Name | 1-Propanol,2,2-dimethyl-, 1-benzoate |
| Synonyms | O-neopentylbenzoate; Benzoesaeure-neopentylester; Neopentyl benzoate; 1-Propanol,2-dimethyl-,benzoate; benzoic acid neopentylester |
| Molecular Formula | (CH3)3CCH2OH |
| Molecular Weight | 88.15 |
| Purity | 99 |
| Density | 0.994g/cm3 |
| Boiling Point | 113-114 °C (lit.) |
| Melting Point | 52-56 °C (lit.) |
| Appearance | crystals |
| EINECS | 200-907-3 |
| HTC | 2916310090 |
| PubChem ID | 24897815 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| InChI | 1S/C5H12O/c1-5(2,3)4-6/h6H,4H2,1-3H3 |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1730984 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/63156_1_3581_70_2.pdf |
| Tax Rebate | 9.0% |
| Supervision | A. Customs clearance form for inbound goods B. Customs clearance form for outbound goods |
| Inspection | R. Imported food hygiene supervision and inspection S. Export food hygiene supervision and inspection M. Imported commodity inspection N. Exported commodity inspection |
| Transport Info | Product name: Supervision conditions A. Customs clearance form for inbound goods B. Customs clearance form for outbound goods |
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| Propanoic acid, 2,2-dimethyl-, 1,1-diethylpropyl ester | 23293-82-5 | 2A-9063153 |
| 2-Propenoic acid, 3-phenyl-, 1,1-dimethylethyl ester | 14990-09-1 | 2A-9063154 |
| Benzenepropanoic acid, 1,1-dimethylethyl ester | 16537-10-3 | 2A-9063155 |
| 2-Butanol, 3,3-dimethyl-, 2-benzoate | 23293-75-6 | 2A-9063157 |
| 3-Pentanol, 3-methyl-, 3-benzoate | 23293-73-4 | 2A-9063158 |
| Cyclohexanol, 1-ethynyl-, 1-benzoate | 23293-77-8 | 2A-9063160 |
| 1-Butanol, 4-chloro-, 1-benzoate | 946-02-1 | 2A-9063161 |
| 1-Propanol, 2,2-dimethyl-, 1-carbamate | 3124-46-7 | 2A-9063163 |
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