2-(3-Chlorophenyl)benzoic Acid - CAS 73178-79-7
Catalog: |
BB034787 |
Product Name: |
2-(3-Chlorophenyl)benzoic Acid |
CAS: |
73178-79-7 |
Synonyms: |
2-(3-chlorophenyl)benzoic acid; 2-(3-chlorophenyl)benzoic acid |
IUPAC Name: | 2-(3-chlorophenyl)benzoic acid |
Description: | 2-(3-Chlorophenyl)benzoic Acid (CAS# 73178-79-7) is a useful research chemical. |
Molecular Weight: | 232.66 |
Molecular Formula: | C13H9ClO2 |
Canonical SMILES: | C1=CC=C(C(=C1)C2=CC(=CC=C2)Cl)C(=O)O |
InChI: | InChI=1S/C13H9ClO2/c14-10-5-3-4-9(8-10)11-6-1-2-7-12(11)13(15)16/h1-8H,(H,15,16) |
InChI Key: | XOBLGZILIGYWAM-UHFFFAOYSA-N |
Boiling Point: | 374 °C at 760 mmHg |
Density: | 1.298 g/cm3 |
LogP: | 3.70520 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3029026-A1 | Novel biphenyl derivative and method for preparing same | 20130730 |
EP-3029026-B1 | Novel biphenyl derivative and method for preparing same | 20130730 |
RU-2644234-C2 | New biphenyl derivative and method for its production | 20130730 |
US-2012282369-A1 | Method for increasing the nutritional value of rapeseed and rape products with decreased oil content | 20110502 |
US-2014171430-A1 | Disubstituted octahydropyrrolo [3,4-c] pyrroles as orexin receptor modulators | 20110420 |
Complexity: | 254 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.0291072 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.0291072 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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