Cas no 16715-77-8 (1-Naphthalenecarboxylicacid, 2,3-dihydroxy-)
16715-77-8 structure
Product Name:1-Naphthalenecarboxylicacid, 2,3-dihydroxy-
1-Naphthalenecarboxylicacid, 2,3-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenecarboxylicacid, 2,3-dihydroxy-
- 2,3-Dihydroxynaphthalene-1-carboxylic acid
- 1-NAPHTHOIC ACID, 2,3-DIHYDROXY-
- 2,3-Dihydroxynaphthoic acid
- AC1L1EED
- NSC 8635
- STK093735
- SureCN88986
- DTXSID00168235
- NSC-8635
- WZPLEIAOQJXZJX-UHFFFAOYSA-N
- AKOS004114665
- NSC8635
- 1-Naphthalenecarboxylic acid, 2,3-dihydroxy-
- BB 0221181
- dihydroxynaphthoic acid
- 2,3-Dihydroxy-1-naphthoic acid
- 16715-77-8
- NCGC00247882-01
- A810825
- .beta.-Oxynaphtoic acid
- SCHEMBL88986
- FT-0768117
- 2,3-Dihydroxy-1-naphthoic acid #
-
- Inchi： 1S/C11H8O4/c12-8-5-6-3-1-2-4-7(6)9(10(8)13)11(14)15/h1-5,12-13H,(H,14,15)
- InChI Key： WZPLEIAOQJXZJX-UHFFFAOYSA-N
- SMILES： OC1=C(C=C2C=CC=CC2=C1C(=O)O)O
Computed Properties
- Exact Mass: 204.04224
- Monoisotopic Mass: 204.042259
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 253
- 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: 77.8
- XLogP3: 2.5
Experimental Properties
- Density: 1.535
- Boiling Point: 464.6 °C at 760 mmHg
- Flash Point: 464.6 °C at 760 mmHg
- Refractive Index: 1.761
- PSA: 77.76
1-Naphthalenecarboxylicacid, 2,3-dihydroxy- Related Literature
-
Carlotta Granchi,Emilia C. Calvaresi,Tiziano Tuccinardi,Ilaria Paterni,Marco Macchia,Adriano Martinelli,Paul J. Hergenrother,Filippo Minutolo Org. Biomol. Chem. 2013 11 6588
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