Cas no 1129-48-2 (Carbamic acid, methyl-,4-methylphenyl ester (9CI))
1129-48-2 structure
Product Name:Carbamic acid, methyl-,4-methylphenyl ester (9CI)
Carbamic acid, methyl-,4-methylphenyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, methyl-,4-methylphenyl ester (9CI)
- Carbamic acid, methyl-, 4-methylphenyl ester
- (4-methylphenyl) N-methylcarbamate
- p-Tolyl methylcarbamate
- DTXSID70150203
- 1129-48-2
- SCHEMBL2182880
- p-Methylphenyl methylcarbamate
-
- Inchi： 1S/C9H11NO2/c1-7-3-5-8(6-4-7)12-9(11)10-2/h3-6H,1-2H3,(H,10,11)
- InChI Key： ZHXCDUWUCWUEPJ-UHFFFAOYSA-N
- SMILES： O(C(NC)=O)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 165.07903
- Monoisotopic Mass: 165.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 151
- 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: 1.7
- Topological Polar Surface Area: 38.3A^2
Experimental Properties
- Density: 1.085
- Boiling Point: 239.9°C at 760 mmHg
- Flash Point: 98.9°C
- Refractive Index: 1.516
- PSA: 38.33
Carbamic acid, methyl-,4-methylphenyl ester (9CI) Related Literature
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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
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
1129-48-2 (Carbamic acid, methyl-,4-methylphenyl ester (9CI)) Related Products
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