1,2-Diphenylethanol - CAS 614-29-9
Catalog: |
BB055917 |
Product Name: |
1,2-Diphenylethanol |
CAS: |
614-29-9 |
Synonyms: |
α-Phenylbenzeneethanol; (±)-1,2-Diphenylethanol; 1,2-Diphenyl-1-hydroxyethane; Benzylphenylcarbinol; NSC 227194; NSC 39; α-Hydroxydibenzyl |
IUPAC Name: | 1,2-diphenylethanol |
Description: | 1,2-Diphenylethanol was used in the study of liver regeneration as influenced by the structure of aromatic and heterocyclic compounds. |
Molecular Weight: | 198.26 |
Molecular Formula: | C14H14O |
Canonical SMILES: | C1=CC=C(C=C1)CC(C2=CC=CC=C2)O |
InChI: | InChI=1S/C14H14O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14-15H,11H2 |
InChI Key: | GBGXVCNOKWAMIP-UHFFFAOYSA-N |
Melting Point: | 66-68°C |
Solubility: | Chloroform (Slightly), Methanol (Very Slightly) |
Appearance: | White Solid |
Storage: | Amber Vial, -20°C Freezer |
References: | Gershbein, L. Res. Commun. Chem. Pathol. Pharmacol., 11, 445 (1975). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
19444823 | 20090615 | Asymmetric allylation of methyl ketones by using chiral phenyl carbinols | Chemistry (Weinheim an der Bergstrasse, Germany) |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.104465066 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.104465066 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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