2-Methyl-1-naphthoic acid - CAS 1575-96-8
Catalog: |
BB011329 |
Product Name: |
2-Methyl-1-naphthoic acid |
CAS: |
1575-96-8 |
Synonyms: |
2-methylnaphthalene-1-carboxylic acid |
IUPAC Name: | 2-methylnaphthalene-1-carboxylic acid |
Description: | 2-Methyl-1-naphthoic acid (CAS# 1575-96-8) is a useful research chemical. |
Molecular Weight: | 186.21 |
Molecular Formula: | C12H10O2 |
Canonical SMILES: | CC1=C(C2=CC=CC=C2C=C1)C(=O)O |
InChI: | InChI=1S/C12H10O2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-7H,1H3,(H,13,14) |
InChI Key: | ZSPDYGICHBLYSD-UHFFFAOYSA-N |
Boiling Point: | 374.3 °C at 760 mmHg |
Density: | 1.222 g/cm3 |
Appearance: | White to tan solid |
MDL: | MFCD00089618 |
LogP: | 2.84640 |
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PMID | Publication Date | Title | Journal |
15969816 | 20050501 | Binding properties of 2-acetylnaphthalene with hydroxypropyl cyclodextrins from fluorescence quenching experiments | Applied spectroscopy |
15626649 | 20050101 | Metabolic biomarkers for monitoring in situ anaerobic hydrocarbon degradation | Environmental health perspectives |
12220410 | 20020901 | Metabolic biomarkers for monitoring anaerobic naphthalene biodegradation in situ | Environmental microbiology |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.068079557 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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