1-Propanol,2,2-dimethyl-, 1-benzoate

Modify Date: 2025-08-25 14:20:09

1-Propanol,2,2-dimethyl-, 1-benzoate Structure
1-Propanol,2,2-dimethyl-, 1-benzoate structure
Common Name 1-Propanol,2,2-dimethyl-, 1-benzoate
CAS Number 3581-70-2 Molecular Weight 192.25400
Density 0.994g/cm3 Boiling Point 251.3ºC at 760 mmHg
Molecular Formula C12H16O2 Melting Point N/A
MSDS N/A Flash Point 110.4ºC

 Names

Name 2,2-dimethylpropyl benzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.994g/cm3
Boiling Point 251.3ºC at 760 mmHg
Molecular Formula C12H16O2
Molecular Weight 192.25400
Flash Point 110.4ºC
Exact Mass 192.11500
PSA 26.30000
LogP 2.88950
Index of Refraction 1.496
InChIKey ZBPDCWGVJKTGND-UHFFFAOYSA-N
SMILES CC(C)(C)COC(=O)c1ccccc1

 Safety Information

HS Code 2916310090

 Synthetic Route

 Customs

HS Code 2916310090
Summary 2916310090 other benzoic acid and its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

 1-Propanol,2,2-dimethyl-, 1-benzoateBioassay

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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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 Synonyms

O-neopentylbenzoate
Benzoesaeure-neopentylester
Neopentyl benzoate
1-Propanol,2-dimethyl-,benzoate
benzoic acid neopentylester
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