Cas no 28527-04-0 (Benzenemethanol,2,5-dimethyl-3-[[(methylamino)carbonyl]oxy]-)
28527-04-0 structure
Product Name:Benzenemethanol,2,5-dimethyl-3-[[(methylamino)carbonyl]oxy]-
CAS No:28527-04-0
MF:C11H15NO3
MW:209.241703271866
CID:281327
PubChem ID:3015418
Update Time:2025-04-19
Benzenemethanol,2,5-dimethyl-3-[[(methylamino)carbonyl]oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol,2,5-dimethyl-3-[[(methylamino)carbonyl]oxy]-
- [3-(hydroxymethyl)-2,5-dimethylphenyl] N-methylcarbamate
- 3-(Hydroxymethyl)-2,5-dimethylphenyl methylcarbamate
- NS00124394
- DTXSID60182750
- Carbamic acid, methyl-, 3-(hydroxymethyl)-2,5-dimethylphenyl ester
- 28527-04-0
-
- Inchi: 1S/C11H15NO3/c1-7-4-9(6-13)8(2)10(5-7)15-11(14)12-3/h4-5,13H,6H2,1-3H3,(H,12,14)
- InChI Key: PLIDENDWVBYBNJ-UHFFFAOYSA-N
- SMILES: O(C(NC)=O)C1=CC(C)=CC(CO)=C1C
Computed Properties
- Exact Mass: 209.10525
- Monoisotopic Mass: 209.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 220
- 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: 1.3
- Topological Polar Surface Area: 58.6?2
Experimental Properties
- Density: 1.148
- Boiling Point: 346.1°Cat760mmHg
- Flash Point: 163.1°C
- Refractive Index: 1.541
- PSA: 58.56
Benzenemethanol,2,5-dimethyl-3-[[(methylamino)carbonyl]oxy]- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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