4-Chlorobenzhydrylamine hydrochloride - CAS 5267-39-0
Catalog: |
BB027904 |
Product Name: |
4-Chlorobenzhydrylamine hydrochloride |
CAS: |
5267-39-0 |
Synonyms: |
(4-chlorophenyl)-phenylmethanamine;hydrochloride |
IUPAC Name: | (4-chlorophenyl)-phenylmethanamine;hydrochloride |
Description: | Intermediate of Levocetirizine. |
Molecular Weight: | 254.16 |
Molecular Formula: | C13H13Cl2N |
Canonical SMILES: | C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N.Cl |
InChI: | InChI=1S/C13H12ClN.ClH/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10;/h1-9,13H,15H2;1H |
InChI Key: | UHPRBUXOILBKFH-UHFFFAOYSA-N |
Boiling Point: | 336.8 ℃ at 760 mmHg |
Melting Point: | 300-305 ℃ |
Purity: | > 95 % |
Density: | 1.175 g/cm3 |
Appearance: | White to off-white crystalline powder |
MDL: | MFCD00013024 |
LogP: | 4.89040 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020131431-A1 | Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors | 20181026 |
EP-3140301-A1 | Pharmacologically active quinazolinedione derivatives | 20140509 |
US-2017137387-A1 | Pharmacologically active quinazolinedione derivatives | 20140509 |
WO-2015169999-A1 | Pharmacologically active quinazolinedione derivatives | 20140509 |
WO-2013085890-A1 | Therapeutic methods | 20111206 |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.0425048 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.0425048 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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