Norcyclobenzaprine

Base Information Edit

Chemical Name:Norcyclobenzaprine
CAS No.:303-50-4
Molecular Formula:C19H19 N
Molecular Weight:261.3609
Hs Code.:
UNII:T6X8KQ83F4
DSSTox Substance ID:DTXSID30952664
Nikkaji Number:J747.857G
Wikidata:Q27164823
ChEMBL ID:CHEMBL1557167
Mol file:303-50-4.mol

Synonyms:Norcyclobenzaprine;Desmethylcyclobenzaprine;303-50-4;Norproheptatrien;10,11-Dehydronortriptyline;3-(5H-Dibenzo[a,d][7]annulen-5-ylidene)-N-methylpropan-1-amine;UNII-T6X8KQ83F4;T6X8KQ83F4;3-(5H-Dibenzo(a,d)cyclohepten-5-ylidene)-N-methyl-1-propanamine;G 38188;N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine;1-Propanamine, 3-(5H-dibenzo(a,d)cyclohepten-5-ylidene)-N-methyl-;Prestwick_807;N-Desmethylcyclobenzaprine;Prestwick0_000513;Prestwick1_000513;Prestwick2_000513;Prestwick3_000513;BSPBio_000465;MLS002153855;SPBio_002386;BPBio1_000513;SCHEMBL2240126;CHEMBL1557167;CHEBI:93101;DTXSID30952664;5-[3-(methylamino)propylidene]-5H-dibenzo[a,d]cycloheptene;HMS1569H07;HMS2096H07;HMS2233K21;HMS3373C08;HMS3713H07;AKOS005065415;CCG-220513;NCGC00016424-01;NCGC00016424-02;CAS-303-50-4;SMR001233213;G-38188;SR-01000841257;SR-01000841257-2;BRD-K63165456-001-03-3;Q27164823;NORTRIPTYLINE HYDROCHLORIDE IMPURITY B [EP IMPURITY];3-(5H-dibenzo[a,d][7]annulen-5-ylidene)-N-methyl-1-propanamine;5H-Dibenzo(a,d)cycloheptene-DELTA5,gamma-propylamine, N-methyl-;5H-DIBENZO(A,D)CYCLOHEPTENE-.DELTA.5,.GAMMA.-PROPYLAMINE, N-METHYL-

Suppliers and Price of Norcyclobenzaprine

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Norcyclobenzaprine
25mg
$ 880.00

Sigma-Aldrich
Norcyclobenzaprine European Pharmacopoeia (EP) Reference Standard
$ 198.00

Sigma-Aldrich
Norcyclobenzaprine European Pharmacopoeia (EP) Reference Standard
n1130000
$ 198.00

Total 1 raw suppliers

Chemical Property of Norcyclobenzaprine Edit

Chemical Property:

Vapor Pressure:5.24E-07mmHg at 25°C
Boiling Point:412.3°Cat760mmHg
PKA:9.97±0.10(Predicted)
Flash Point:204.4°C
PSA：12.03000
Density:1.106g/cm³
LogP:4.60250
Solubility.:Chloroform
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:261.151749610
Heavy Atom Count:20
Complexity:340

Purity/Quality:

98%min ^*data from raw suppliers

Norcyclobenzaprine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNCCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31
Uses Norcyclobenzaprine is an intermediate in the synthesis of Cyclobenzaprine N-β-D-Glucuronide (C987755). Cyclobenzaprine N-β-D-Glucuronide is a metabolite of Cyclobenzaprine.

Technology Process of Norcyclobenzaprine

There total 11 articles about Norcyclobenzaprine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 83.0%

: cyclobenzaprine hydrochloride

: 303-50-4
5-[3-(methylamino)propylidene]-5H-dibenzo[a,d]cycloheptene

Guidance literature:: cyclobenzaprine hydrochloride; With sodium hydrogencarbonate; In chloroform; water; at 20 ℃; for 0.166667h;

With chloroformic acid ethyl ester; In toluene; at 80 ℃; for 72h;

With potassium hydroxide; In butan-1-ol; at 120 ℃; for 4h;