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Predicted properties of the compound entered.

ID AAOVKJBEBIDNHE-UHFFFAOYSA-N
Formula C16H13ClN2O
IUPAC Name 7-chloro-1-methyl-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
Standard InChIKey (User Input) InChIKey=AAOVKJBEBIDNHE-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one | 439-14-5 | 11100-37-1 | 53320-84-6 | Diazepamum [INN-Latin] | NSC169897 | Diazepan leo | Spectrum3_001780 | Diazepin | Vanconin | Reliver | Dipaz | Diazepam Desitin | Caudel | Disopam | IDI1_000967 | Placidox 5 | Dizac | DivK1c_000967 | Doval | KBio1_000967 | Drenian | Vazen | Sico Relax | Ducene | ZINC00006427 | Centrazepam | Dupin | EINECS 207-122-5 | Diastat (TN) | Placidox 10 | Elcion CR | Euphorin P | Simasedan | Evacalm | InChI=1/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H | AIDS001617 | Ro 5-2805 | Chuansuan | Diapine | Gewacalm | Gradual | Gubex | Sipam | HSDB 3057 | NINDS_000967 | D-Pam | Iazepam | Jinpanfan | Kabivitrum | Kratium | Trankinon | Kratium 2 | DEA No. 2765 | LA-111 | Lizan | SMR000058398 | Lovium | Mandro | Trazepam | C06948 | Diazepam | DZP | Spectrum4_000576 | Mentalium | Mandro-Zep | Metamidol | MLS000759402 | Methyl diazepinone | Valaxona | Methyldiazepinone (pharmaceutical) | Desconet | Metil Gobanal | NSC 169897 | Diazepam (JP15/USP/INN) | NSC-77518 | Nellium | Spectrum5_001890 | Valiquid | Oprea1_126223 | Nerozen | Diazepam solution | Desloneg | Nervium | KBio3_002780 | nchembio747-comp27 | Nivalen | Nixtensyn | Notense | Valrelease | Novazam | Faustal | Diaceplex | Novodipam | Pomin | Ortopsique | Valium (TN) | Paceum | Paralium | Valuzepam | Paxum | Parzam | D9900_SIGMA | 5-24-04-00300 (Beilstein Handbook Reference) | An-Ding | Ansilive | Antenex | Anxicalm | Anxionil | Apo-diazepam | Arzepam | Azedipamin | BRN 0754371 | Baogin | Benzopin | Best | Betapam | Britazepam | CCRIS 6009 | 1-Methyl-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one | 2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-1-methyl-5-phenyl- | 7-Chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one | 7-Chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine | 7-Chloro-1-methyl-5-3H-1,4-benzodiazepin-2(1H)-one | 7-Chloro-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one | 7-Chloro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one | 7-Chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2(1H)-one | Alboral | Aliseum | Amiprol | Ansiolin | Ansiolisina | Apaurin | Apozepam | Armonil | Assival | Atensine | Atilen | Bensedin | Bialzepam | CB 4261 | Calmocitene | Calmpose | Cercine | Ceregulart | Condition | Diacepan | Dialag | Diapam | Diazemuls | Diazepan | Diazetard | Dienpax | Dipezona | Domalium | Duksen | Duxen | Eridan | Eurosan | Faustan | Faustan, | Freudal | Frustan | Gihitan | Horizon | Kiatrium | LA 111 | LA III | La-Iii | Lamra | Lembrol | Levium | Liberetas | Methyldiazepinone | Methyldiazepinone, pharmaceutical | Morosan | NSC77518 | Neurolytril | Noan | Medipam | Paranten | Paxate | Paxel | Plidan | Quetinil | Quiatril | Quievita | Relaminal | Relanium | Relax | Renborin | Ro 5-2807 | Ruhsitus | S.a. r.l. | Saromet | Sedipam | Seduksen | Seduxen | Serenack | Serenamin | Serenzin | Setonil | Sibazon | Solis | Sonacon | Stesolid | Stesolin | Tensopam | Tranimul | Tranqdyn | Tranquirit | Umbrium | Unisedil | Usempax ap | Valeo | Valitran | Valium | Vatran | Velium | Vival | Vivol | WLN: T67 GNV JN IHJ CG G1 KR | WY-3467 | Wy 3467 | Zipan | e-Pam | Winii | A3662/0155188 | Diaquel | Zepaxid | Diastat | D00293 | AIDS-001617 | Diatran | Diazem | Prozepam | Diazepam Dak | Calmaven | Diapax | Diazepam Elmu | BSPBio_003279 | Diazepam Fabra | Diazepam Nordic | Psychopax | Diazepam Rectubes | Calmociteno | Diazepam Stada | Diazepam [USAN:BAN:INN:JAN] | KBioGR_001012 | Dialar | Diazepam-Eurogenerics | Diazepam-Lipuro | Radizepam | D0899_SIGMA | Diazepam-ratiopharm | Placidox 2 | Calmod | Diazepamu [Polish]
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
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Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
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Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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1H NMR prediction -
13C NMR prediction -
COSY -
HSQC/HMBC prediction -
All prediction -