Chlordiazepoxide hydrochloride
Properties
- Molecular formula
- C16H15Cl2N3O
- Molar mass
- 336.22 g/mol
- Exact mass
- 335.0592 Da
- Melting point
- 213 °C
- logP
- 3.56Crippen estimate
- Polar surface area
- 50.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
438-41-5SMILES
CN=C1C[N+]([O-])=C(c2ccccc2)c2cc(Cl)ccc2N1.ClInChIKey
DMLFJMQTNDSRFU-UHFFFAOYSA-NInChI
InChI=1S/C16H14ClN3O.ClH/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15;/h2-9H,10H2,1H3,(H,18,19);1HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
29 names · show all
- Sigma C 2517
- 3H-1,4-Benzodiazepin-2-amine, 7-chloro-N-methyl-5-phenyl-, 4-oxide, hydrochloride (1:1)
- 3H-1,4-Benzodiazepine, 7-chloro-2-(methylamino)-5-phenyl-, 4-oxide, monohydrochloride
- 3H-1,4-Benzodiazepin-2-amine, 7-chloro-N-methyl-5-phenyl-, 4-oxide, monohydrochloride
- Ro 5-0690
- 7-Chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepine-4-oxide hydrochloride
- Librium hydrochloride
- Methaminodiazepoxide hydrochloride
- Chlordiazepoxide monohydrochloride
- Librium
- Contol
- Chlorodiazepoxide hydrochloride
- Disarim
- Viansin
- Equibral
- Psicoterina
- Labican
- Cebrum
- SK-Lygen
- Corax
- A-Poxide
- Seren vita
- Ansiacal
- NSC 115748
- OCM
- Reliberan
- Psichial
- Benzodiapin
- Lentotran
Work with Chlordiazepoxide hydrochloride
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Demoxepam963-39-363 % similar
7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepine-2-thione4547-02-841 % similar
2-Chloroacetamido-5-chlorobenzophenone4016-85-739 % similar
2-(Methylamino)-5-chlorobenzophenone1022-13-537 % similar
Oxazepam604-75-137 % similar
Delorazepam2894-67-934 % similar
Desalkylflurazepam2886-65-932 % similar
Nitrazepam146-22-532 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.