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Lorazepam

CAS: 846-49-1 | C15H10Cl2N2O2

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number: 846-49-1
Molecular Formula: C15H10Cl2N2O2
Molecular Weight: 321.163 g/mol

Names and Synonyms:

Lorazepam Common Name
Titus Synonym
Trapex Synonym
NIC Synonym
7-Chloro-5-(2-chlorophenyl)-3-hydroxy-1H-1,4-benzodiazepin-2(3H)-one Synonym
Lorazem Synonym
Tavor Expidet Synonym
NSC 289758 Synonym
Lorsilan Synonym
Pro Dorm Synonym
Somagerol Synonym
Quait Synonym
Sedazin Synonym
Securit Synonym
Psicopax Synonym
Emotival Synonym
Control Synonym
Stapam Synonym
Reposepan Synonym
Sinestron Synonym
Tranqipam Synonym
Rocosgen Synonym
Lorazin Synonym
Aplacasse Synonym
Lorivan Synonym
Lorzem Synonym
Kalmalin Synonym
Trapax Synonym
Equitam Synonym
Lorazon Synonym
Aripax Synonym
Anzepam Synonym
Anxira Synonym
Azurogen Synonym
Silence Synonym
Laubeel Synonym
Lopam Synonym
Anxiedin Synonym
Bonton Synonym
Loridem Synonym
Sedizepan Synonym
Lozepam Synonym
Lorazene Synonym
Punktyl Synonym
Lorans Synonym
Duralozam Synonym
Nervistop L Synonym
Sidenar Synonym
Sedatival Synonym
Efasedan Synonym
Lorsedal Synonym
Lorax Synonym
Lorazep Synonym
Upan Synonym
Novhepar Synonym
Lorat Synonym
Bonatranquan Synonym
Renaquil Synonym
Wintin Synonym
Lorenin Synonym
Merlit Synonym
Lorabenz Synonym
Loram Synonym
Novo-lorazem Synonym
Aplacassee Synonym
Larpose Synonym
Lorapam Synonym
Apo-Lorazepam Synonym
Orfidal Synonym
Almazine Synonym
(RS)-Lorazepam Synonym
(±)-Lorazepam Synonym
Delormetazepam Synonym
Norlormetazepam Synonym
Wypax Synonym
Ativan Synonym
Tavor Synonym
Temesta Synonym
o-Chloroxazepam Synonym
o-Chlorooxazepam Synonym
Demethyllormetazepam Synonym
Lorazepam Synonym
Wy 4036 Synonym
7-Chloro-5-(o-chlorophenyl)-1,3-dihydro-3-hydroxy-2H-1,4-benzodiazepin-2-one Synonym
7-Chloro-5-(2-chlorophenyl)-1,3-dihydro-3-hydroxy-2H-1,4-benzodiazepin-2-one Synonym
2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(o-chlorophenyl)-1,3-dihydro-3-hydroxy- Synonym
2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(2-chlorophenyl)-1,3-dihydro-3-hydroxy- Synonym

Identifiers:

SMILES:
OC1=Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1O
InChI:
InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

All Properties

Comprehensive physical and chemical properties

Physical Properties

Property Value Source
molecular_mass 321.16 g/mol Legacy Database
cas-canonical-smile O=C1NC=2C=CC(Cl)=CC2C(=NC1O)C=3C=CC=CC3Cl None Legacy Database
cas-inchi InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20) None Legacy Database
cas-inchi-key InChIKey=DIWRORZWFLOCLC-UHFFFAOYSA-N None Legacy Database
cas-melting-point 167 °C None Legacy Database
cas-name Lorazepam None Legacy Database
LogP 3.750800000000002 RDKit

Molecular

Property Value Source
Molecular Weight 321.163 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 320.01193292 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 21 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 3 count RDKit
Hydrogen Bond Donors 2 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 1 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 2 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 65.18 Ų RDKit

Molar

Property Value Source
Molar Refractivity 84.27360000000002 RDKit

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