Cas no 68267-12-9 (1,7-dicarbomethoxynaphthalene)
1,7-dicarbomethoxynaphthalene structure
Product Name:1,7-dicarbomethoxynaphthalene
CAS No:68267-12-9
MF:C14H12O4
MW:244.242684364319
CID:863101
Update Time:2024-03-05
1,7-dicarbomethoxynaphthalene Chemical and Physical Properties
Names and Identifiers
-
- 1,7-dicarbomethoxynaphthalene
- 1,7-naphthalenedicarboxylic acid, dimethyl ester
- Dimethyl naphthalene-1,7-dicarboxylate
- LogP
- Dimethyl 1,7-naphthalenedicarboxylate
- 1,7-Naphthalenedicarboxylic acid, 1,7-dimethyl ester
-
- Inchi： 1S/C14H12O4/c1-17-13(15)10-7-6-9-4-3-5-11(12(9)8-10)14(16)18-2/h3-8H,1-2H3
- InChI Key： PHQPWDYQGMVULG-UHFFFAOYSA-N
- SMILES： C1(C(OC)=O)=C2C(C=CC(C(OC)=O)=C2)=CC=C1
Computed Properties
- Exact Mass: 244.07356
- Monoisotopic Mass: 244.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 326
- 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
- Topological Polar Surface Area: 52.6A^2
Experimental Properties
- Density: 1.225
- Melting Point: 83-85.2 °C
- Boiling Point: 375.3°C at 760 mmHg
- Flash Point: 189.2°C
- Refractive Index: 1.594
- PSA: 52.6
1,7-dicarbomethoxynaphthalene Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
68267-12-9 (1,7-dicarbomethoxynaphthalene) Related Products
- 1679-64-7(Mono-Methyl terephthalate)
- 2459-25-8(Methyl 2-naphthoate)
- 6908-41-4(Methyl 4-(hydroxymethyl)benzoate)
- 99-75-2(Methyl p-Toluate)
- 1459-93-4(Dimethyl isophthalate)
- 52178-50-4(Methyl 3-formylbenzoate)
- 1877-71-0(Monomethyl Isophthalate)
- 120-61-6(Dimethyl terephthalate)
- 840-65-3(Dimethyl naphthalene-2,6-dicarboxylate)
- 99-36-5(Methyl 3-methylbenzoate)
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