Cas no 3581-70-2 (1-Propanol,2,2-dimethyl-, 1-benzoate)
3581-70-2 structure
Product Name:1-Propanol,2,2-dimethyl-, 1-benzoate
CAS No:3581-70-2
MF:C12H16O2
MW:192.254243850708
MDL:MFCD28365339
CID:320312
PubChem ID:219497
Update Time:2025-09-24
1-Propanol,2,2-dimethyl-, 1-benzoate Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanol,2,2-dimethyl-, 1-benzoate
- 2,2-dimethylpropyl benzoate
- 1-Propanol,2-dimethyl-, benzoate
- AC1L56UX
- AC1Q62R5
- Benzoesaeure-neopentylester
- benzoic acid neopentylester
- CTK4H5390
- neo-pentyl benzoate
- Neopentyl benzoate
- NSC895
- O-neopentylbenzoate
- SureCN444012
- SCHEMBL444012
- ZBPDCWGVJKTGND-UHFFFAOYSA-N
- DTXSID40277113
- NSC-895
- Neopentyl benzoate #
- 3581-70-2
- Benzoic acid neopentyl ester
-
- MDL： MFCD28365339
- Inchi： 1S/C12H16O2/c1-12(2,3)9-14-11(13)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
- InChI Key： ZBPDCWGVJKTGND-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1)=O)CC(C)(C)C
Computed Properties
- Exact Mass: 192.11508
- Monoisotopic Mass: 192.11503
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 185
- 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: 4
- Topological Polar Surface Area: 26.3
Experimental Properties
- Density: 0.994
- Boiling Point: 251.3°C at 760 mmHg
- Flash Point: 110.4°C
- Refractive Index: 1.496
- PSA: 26.3
1-Propanol,2,2-dimethyl-, 1-benzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| eNovation Chemicals LLC | D100214-1g |
1-Propanol, 2,2-dimethyl-, 1-benzoate |
3581-70-2 | 95% | 1g |
$490 | 2025-02-20 | |
| eNovation Chemicals LLC | D100214-1g |
1-Propanol, 2,2-dimethyl-, 1-benzoate |
3581-70-2 | 95% | 1g |
$490 | 2024-06-05 | |
| eNovation Chemicals LLC | D100214-1g |
1-Propanol, 2,2-dimethyl-, 1-benzoate |
3581-70-2 | 95% | 1g |
$490 | 2025-03-01 |
1-Propanol,2,2-dimethyl-, 1-benzoate Related Literature
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
3581-70-2 (1-Propanol,2,2-dimethyl-, 1-benzoate) Related Products
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- 4196-89-8(Neopentyl glycol dibenzoate)
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